Hydrochlorides

An organic complex formed of an organic base in association with hydrogen chloride; also known as chlorhydrate, and as an acid salt.

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Isoindoline hydrochloride, 97%

CAS: 32372-82-0 Molecular Formula: C8H10ClN Molecular Weight (g/mol): 155.63 MDL Number: MFCD03502377 InChI Key: NOVIRODZMIZUPA-UHFFFAOYSA-N Synonym: isoindoline hydrochloride,2,3-dihydroisoindole hydrochloride,2,3-dihydro-1h-isoindole hydrochloride,2,3-dihydro-1h-isoindole hcl,1h-isoindole, 2,3-dihydro-, hydrochloride,isoindolinehydrochloride,isoindoline hcl,d0y1rn,dihydroisoindole hydrochloride,ksc491i3f PubChem CID: 12311031 SMILES: Cl.C1NCC2=CC=CC=C12

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Specifications

PubChem CID	12311031
CAS	32372-82-0
Molecular Weight (g/mol)	155.63
MDL Number	MFCD03502377
SMILES	Cl.C1NCC2=CC=CC=C12
Synonym	isoindoline hydrochloride,2,3-dihydroisoindole hydrochloride,2,3-dihydro-1h-isoindole hydrochloride,2,3-dihydro-1h-isoindole hcl,1h-isoindole, 2,3-dihydro-, hydrochloride,isoindolinehydrochloride,isoindoline hcl,d0y1rn,dihydroisoindole hydrochloride,ksc491i3f
InChI Key	NOVIRODZMIZUPA-UHFFFAOYSA-N
Molecular Formula	C8H10ClN

Ethyl 1-aminocyclopropanecarboxylate hydrochloride, 98%

CAS: 42303-42-4 Molecular Formula: C₆H₁₁NO₂·ClH Molecular Weight (g/mol): 165.62 MDL Number: MFCD00190747 InChI Key: XFNUTZWASODOQK-UHFFFAOYSA-N Synonym: ethyl 1-aminocyclopropanecarboxylate hydrochloride,1-aminocyclopropane-1-carboxylic acid ethyl ester hydrochloride,h-acpc-oet.hcl,ethyl 1-aminocyclopropane-1-carboxylate hydrochloride,1-amino-cyclopropyl-1-carboxylic acid ethyl ester hydrochloride,h-acpc-oet hcl,1-aminocyclopropane-1-carboxylic acid ethyl ester,acpc-oet-hcl,h-acpc-oet?cl,pubchem14733 PubChem CID: 386203 IUPAC Name: ethyl 1-aminocyclopropane-1-carboxylate;hydrochloride SMILES: CCOC(=O)C1(CC1)N.Cl

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PubChem CID	386203
CAS	42303-42-4
Molecular Weight (g/mol)	165.62
MDL Number	MFCD00190747
SMILES	CCOC(=O)C1(CC1)N.Cl
Synonym	ethyl 1-aminocyclopropanecarboxylate hydrochloride,1-aminocyclopropane-1-carboxylic acid ethyl ester hydrochloride,h-acpc-oet.hcl,ethyl 1-aminocyclopropane-1-carboxylate hydrochloride,1-amino-cyclopropyl-1-carboxylic acid ethyl ester hydrochloride,h-acpc-oet hcl,1-aminocyclopropane-1-carboxylic acid ethyl ester,acpc-oet-hcl,h-acpc-oet?cl,pubchem14733
IUPAC Name	ethyl 1-aminocyclopropane-1-carboxylate;hydrochloride
InChI Key	XFNUTZWASODOQK-UHFFFAOYSA-N
Molecular Formula	C₆H₁₁NO₂·ClH

Carboxymethoxylamine HemiHydroChloride, 98%

CAS: 2921-14-4 Molecular Formula: C4H11ClN2O6 Molecular Weight (g/mol): 218.59 MDL Number: MFCD00012955 InChI Key: AXIKLJPWEGNZIG-UHFFFAOYSA-N Synonym: o-carboxymethyl hydroxylamine hemihydrochloride,carboxymethoxylamine hemihydrochloride,aminooxyacetic acid hemihydrochloride,2-aminooxy acetic acid hydrochloride 2:1,unii-5g5qi2gn7a,acetic acid, aminooxy-, hydrochloride 2:1,aminooxy acetic acid hemihydrochloride,5g5qi2gn7a,carboxymethoxyamine hemihydrochloride PubChem CID: 2723609 IUPAC Name: 2-aminooxyacetic acid;hydrochloride SMILES: [Cl-].NOCC(O)=O.[NH3+]OCC(O)=O

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Specifications

PubChem CID	2723609
CAS	2921-14-4
Molecular Weight (g/mol)	218.59
MDL Number	MFCD00012955
SMILES	[Cl-].NOCC(O)=O.[NH3+]OCC(O)=O
Synonym	o-carboxymethyl hydroxylamine hemihydrochloride,carboxymethoxylamine hemihydrochloride,aminooxyacetic acid hemihydrochloride,2-aminooxy acetic acid hydrochloride 2:1,unii-5g5qi2gn7a,acetic acid, aminooxy-, hydrochloride 2:1,aminooxy acetic acid hemihydrochloride,5g5qi2gn7a,carboxymethoxyamine hemihydrochloride
IUPAC Name	2-aminooxyacetic acid;hydrochloride
InChI Key	AXIKLJPWEGNZIG-UHFFFAOYSA-N
Molecular Formula	C4H11ClN2O6

O-Ethylhydroxylamine hydrochloride, 99.0-101.0 wt. % (AT), MilliporeSigma™ Supelco™

MDL Number: MFCD00012956 Synonym: Ethoxyamine hydrochloride

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Specifications

MDL Number	MFCD00012956
Synonym	Ethoxyamine hydrochloride

3-Picolyl chloride hydrochloride, 99%

CAS: 6959-48-4 Molecular Formula: C₆H₆ClN·HCl Molecular Weight (g/mol): 164.04 MDL Number: MFCD00012818 InChI Key: UZGLOGCJCWBBIV-UHFFFAOYSA-N Synonym: 3-chloromethyl pyridine hydrochloride,3-chloromethylpyridine hydrochloride,3-picolyl chloride hydrochloride,3-chloromethyl pyridine hcl,ccris 140,pyridine, 3-chloromethyl-, hydrochloride,3-pyridylmethyl chloride hydrochloride,unii-bqa8fyp4yn,3-chloromethyl pyridinium chloride,3-chloromethyl pyridine.hcl PubChem CID: 23394 IUPAC Name: 3-(chloromethyl)pyridine;hydrochloride SMILES: C1=CC(=CN=C1)CCl.Cl

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Specifications

PubChem CID	23394
CAS	6959-48-4
Molecular Weight (g/mol)	164.04
MDL Number	MFCD00012818
SMILES	C1=CC(=CN=C1)CCl.Cl
Synonym	3-chloromethyl pyridine hydrochloride,3-chloromethylpyridine hydrochloride,3-picolyl chloride hydrochloride,3-chloromethyl pyridine hcl,ccris 140,pyridine, 3-chloromethyl-, hydrochloride,3-pyridylmethyl chloride hydrochloride,unii-bqa8fyp4yn,3-chloromethyl pyridinium chloride,3-chloromethyl pyridine.hcl
IUPAC Name	3-(chloromethyl)pyridine;hydrochloride
InChI Key	UZGLOGCJCWBBIV-UHFFFAOYSA-N
Molecular Formula	C₆H₆ClN·HCl

2-(Aminomethyl)benzimidazole dihydrochloride hydrate, 98%

CAS: 5993-91-9 Molecular Formula: C8H11Cl2N3 Molecular Weight (g/mol): 220.10 MDL Number: MFCD00012677 InChI Key: HAEYZZSSSUIZAN-UHFFFAOYSA-N Synonym: 1h-benzo d imidazol-2-yl methanamine dihydrochloride,2-aminomethyl benzimidazole dihydrochloride,1h-benzimidazole-2-methanamine, dihydrochloride,1h-1,3-benzodiazol-2-ylmethanamine dihydrochloride,1h-1,3-benzodiazol-2-yl methanamine dihydrochloride,2-aminomethylbenzimidazole dihydrochloride,c-1h-benzoimidazol-2-yl-methylamine dihydrochloride,benzimidazol-2-ylmethylamine, chloride, chloride,1-1h-1,3-benzodiazol-2-yl methanamine dihydrochloride,1h-benzo d imidazol-2-yl methanamine 2hcl PubChem CID: 2723957 IUPAC Name: 1H-benzimidazol-2-ylmethanamine;dihydrochloride SMILES: Cl.Cl.NCC1=NC2=CC=CC=C2N1

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Specifications

PubChem CID	2723957
CAS	5993-91-9
Molecular Weight (g/mol)	220.10
MDL Number	MFCD00012677
SMILES	Cl.Cl.NCC1=NC2=CC=CC=C2N1
Synonym	1h-benzo d imidazol-2-yl methanamine dihydrochloride,2-aminomethyl benzimidazole dihydrochloride,1h-benzimidazole-2-methanamine, dihydrochloride,1h-1,3-benzodiazol-2-ylmethanamine dihydrochloride,1h-1,3-benzodiazol-2-yl methanamine dihydrochloride,2-aminomethylbenzimidazole dihydrochloride,c-1h-benzoimidazol-2-yl-methylamine dihydrochloride,benzimidazol-2-ylmethylamine, chloride, chloride,1-1h-1,3-benzodiazol-2-yl methanamine dihydrochloride,1h-benzo d imidazol-2-yl methanamine 2hcl
IUPAC Name	1H-benzimidazol-2-ylmethanamine;dihydrochloride
InChI Key	HAEYZZSSSUIZAN-UHFFFAOYSA-N
Molecular Formula	C8H11Cl2N3

m-Phenylenediamine dihydrochloride, 99%

CAS: 541-69-5 Molecular Formula: C₆H₈N₂·₂ClH Molecular Weight (g/mol): 181.07 MDL Number: MFCD00012975 InChI Key: SVTOYMIYCMHPIV-UHFFFAOYSA-N Synonym: benzene-1,3-diamine dihydrochloride,m-phenylenediamine dihydrochloride,1,3-phenylenediamine dihydrochloride,1,3-benzenediamine dihydrochloride,1,3-benzenediamine, dihydrochloride,m-phenylenediamine hydrochloride,unii-se5rlo93tg,1,3-diaminobenzene dihydrochloride,m-aminoaniline dihydrochloride,3-aminoaniline dihydrochloride PubChem CID: 10941 IUPAC Name: benzene-1,3-diamine;dihydrochloride SMILES: C1=CC(=CC(=C1)N)N.Cl.Cl

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Specifications

PubChem CID	10941
CAS	541-69-5
Molecular Weight (g/mol)	181.07
MDL Number	MFCD00012975
SMILES	C1=CC(=CC(=C1)N)N.Cl.Cl
Synonym	benzene-1,3-diamine dihydrochloride,m-phenylenediamine dihydrochloride,1,3-phenylenediamine dihydrochloride,1,3-benzenediamine dihydrochloride,1,3-benzenediamine, dihydrochloride,m-phenylenediamine hydrochloride,unii-se5rlo93tg,1,3-diaminobenzene dihydrochloride,m-aminoaniline dihydrochloride,3-aminoaniline dihydrochloride
IUPAC Name	benzene-1,3-diamine;dihydrochloride
InChI Key	SVTOYMIYCMHPIV-UHFFFAOYSA-N
Molecular Formula	C₆H₈N₂·₂ClH

1,3-Benzothiazol-2-ylmethylamine hydrochloride, ≥97%, Thermo Scientific™

CAS: 29198-41-2 Molecular Formula: C8H9ClN2S Molecular Weight (g/mol): 200.684 MDL Number: MFCD03783535 InChI Key: WCZDQDCFSDCIIC-UHFFFAOYSA-N Synonym: 1,3-benzothiazol-2-ylmethylamine hydrochloride,benzo d thiazol-2-ylmethanamine hydrochloride,1,3-benzothiazol-2-ylmethanamine hydrochloride,2-aminomethyl-1,3-benzothiazole hydrochloride,1-1,3-benzothiazol-2-yl methanamine hydrochloride,1,3-benzothiazol-2-yl-methanamine hydrochloride,c8h8n2s.clh,bestipharma 508-458,benzothiazol-2-ylmethylamine, chloride,benzothiazol-2-ylmethylamine hcl PubChem CID: 2776261 IUPAC Name: 1,3-benzothiazol-2-ylmethanamine;hydrochloride SMILES: C1=CC=C2C(=C1)N=C(S2)CN.Cl

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Specifications

PubChem CID	2776261
CAS	29198-41-2
Molecular Weight (g/mol)	200.684
MDL Number	MFCD03783535
SMILES	C1=CC=C2C(=C1)N=C(S2)CN.Cl
Synonym	1,3-benzothiazol-2-ylmethylamine hydrochloride,benzo d thiazol-2-ylmethanamine hydrochloride,1,3-benzothiazol-2-ylmethanamine hydrochloride,2-aminomethyl-1,3-benzothiazole hydrochloride,1-1,3-benzothiazol-2-yl methanamine hydrochloride,1,3-benzothiazol-2-yl-methanamine hydrochloride,c8h8n2s.clh,bestipharma 508-458,benzothiazol-2-ylmethylamine, chloride,benzothiazol-2-ylmethylamine hcl
IUPAC Name	1,3-benzothiazol-2-ylmethanamine;hydrochloride
InChI Key	WCZDQDCFSDCIIC-UHFFFAOYSA-N
Molecular Formula	C8H9ClN2S

(R)-(-)-3-Fluoropyrrolidine hydrochloride, 97%

CAS: 136725-55-8 Molecular Formula: C4H9ClFN Molecular Weight (g/mol): 125.571 MDL Number: MFCD04038717 InChI Key: LENYOXXELREKGZ-PGMHMLKASA-N Synonym: r-3-fluoropyrrolidine hydrochloride,r---3-fluoropyrrolidine hydrochloride,3r-3-fluoropyrrolidine hydrochloride,r---3-fluoropyrrolidinehydrochloride,r-3-fluoro-pyrrolidine hcl,3r---3-fluoropyrrolidine hydrochloride,pyrrolidine, 3-fluoro-, hydrochloride, 3r,snxdjhbrbbruuuqx@,r-3-fluoropyrrolidine hcl PubChem CID: 2759162 IUPAC Name: (3R)-3-fluoropyrrolidine;hydrochloride SMILES: C1CNCC1F.Cl

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Specifications

PubChem CID	2759162
CAS	136725-55-8
Molecular Weight (g/mol)	125.571
MDL Number	MFCD04038717
SMILES	C1CNCC1F.Cl
Synonym	r-3-fluoropyrrolidine hydrochloride,r---3-fluoropyrrolidine hydrochloride,3r-3-fluoropyrrolidine hydrochloride,r---3-fluoropyrrolidinehydrochloride,r-3-fluoro-pyrrolidine hcl,3r---3-fluoropyrrolidine hydrochloride,pyrrolidine, 3-fluoro-, hydrochloride, 3r,snxdjhbrbbruuuqx@,r-3-fluoropyrrolidine hcl
IUPAC Name	(3R)-3-fluoropyrrolidine;hydrochloride
InChI Key	LENYOXXELREKGZ-PGMHMLKASA-N
Molecular Formula	C4H9ClFN

N-Benzyloxycarbonyl-1,3-propanediamine hydrochloride, 98%

CAS: 17400-34-9 Molecular Formula: C11H17ClN2O2 Molecular Weight (g/mol): 244.72 MDL Number: MFCD00270153 InChI Key: XKMBTMXQMDLSRB-UHFFFAOYSA-N Synonym: n-cbz-1,3-diaminopropane hydrochloride,benzyl 3-aminopropyl carbamate hydrochloride,benzyl n-3-aminopropyl carbamate hydrochloride,n-cbz-1,3-diaminopropane-hcl,n-z-1,3-propanediamine hydrochloride,n-carbobenzoxy-1,3-diaminopropane hydrochloride,n-carbobenzyloxy-1,3-diaminopropane hydrochloride,n-3-aminopropyl carbamic acid benzyl ester hydrochloride,n-1-z-1,3-diaminopropane hcl,n-z-1,3-diaminopropane hydrochloride PubChem CID: 13196227 SMILES: [H+].[Cl-].NCCCNC(=O)OCC1=CC=CC=C1

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Specifications

PubChem CID	13196227
CAS	17400-34-9
Molecular Weight (g/mol)	244.72
MDL Number	MFCD00270153
SMILES	[H+].[Cl-].NCCCNC(=O)OCC1=CC=CC=C1
Synonym	n-cbz-1,3-diaminopropane hydrochloride,benzyl 3-aminopropyl carbamate hydrochloride,benzyl n-3-aminopropyl carbamate hydrochloride,n-cbz-1,3-diaminopropane-hcl,n-z-1,3-propanediamine hydrochloride,n-carbobenzoxy-1,3-diaminopropane hydrochloride,n-carbobenzyloxy-1,3-diaminopropane hydrochloride,n-3-aminopropyl carbamic acid benzyl ester hydrochloride,n-1-z-1,3-diaminopropane hcl,n-z-1,3-diaminopropane hydrochloride
InChI Key	XKMBTMXQMDLSRB-UHFFFAOYSA-N
Molecular Formula	C11H17ClN2O2

2-Iminothiolane Hydrochloride, 98%

CAS: 4781-83-3 Molecular Formula: C₄H₇NS·ClH Molecular Weight (g/mol): 137.63 InChI Key: ATGUDZODTABURZ-UHFFFAOYSA-N Synonym: 2-iminothiolane hydrochloride,2-iminothiolane hcl,thiolan-2-imine hydrochloride,dihydrothiophen-2 3h-imine hydrochloride,2 3h-thiophenimine, dihydro-, hydrochloride,traut's reagent,c4h7ns.clh,traut eo 1/4 a,2-thiolanimine hydrochloride,2 3h-thiophenimine, hydrochloride PubChem CID: 13166855 IUPAC Name: thiolan-2-imine;hydrochloride SMILES: C1CC(=N)SC1.Cl

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Specifications

PubChem CID	13166855
CAS	4781-83-3
Molecular Weight (g/mol)	137.63
SMILES	C1CC(=N)SC1.Cl
Synonym	2-iminothiolane hydrochloride,2-iminothiolane hcl,thiolan-2-imine hydrochloride,dihydrothiophen-2 3h-imine hydrochloride,2 3h-thiophenimine, dihydro-, hydrochloride,traut's reagent,c4h7ns.clh,traut eo 1/4 a,2-thiolanimine hydrochloride,2 3h-thiophenimine, hydrochloride
IUPAC Name	thiolan-2-imine;hydrochloride
InChI Key	ATGUDZODTABURZ-UHFFFAOYSA-N
Molecular Formula	C₄H₇NS·ClH

3-(Chloromethyl)pyridine hydrochloride, 97%

CAS: 6959-48-4 Molecular Formula: C6H7Cl2N Molecular Weight (g/mol): 164.029 MDL Number: MFCD00012818 InChI Key: UZGLOGCJCWBBIV-UHFFFAOYSA-N Synonym: 3-chloromethyl pyridine hydrochloride,3-chloromethylpyridine hydrochloride,3-picolyl chloride hydrochloride,3-chloromethyl pyridine hcl,ccris 140,pyridine, 3-chloromethyl-, hydrochloride,3-pyridylmethyl chloride hydrochloride,unii-bqa8fyp4yn,3-chloromethyl pyridinium chloride,3-chloromethyl pyridine.hcl PubChem CID: 23394 IUPAC Name: 3-(chloromethyl)pyridine;hydrochloride SMILES: C1=CC(=CN=C1)CCl.Cl

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Specifications

PubChem CID	23394
CAS	6959-48-4
Molecular Weight (g/mol)	164.029
MDL Number	MFCD00012818
SMILES	C1=CC(=CN=C1)CCl.Cl
Synonym	3-chloromethyl pyridine hydrochloride,3-chloromethylpyridine hydrochloride,3-picolyl chloride hydrochloride,3-chloromethyl pyridine hcl,ccris 140,pyridine, 3-chloromethyl-, hydrochloride,3-pyridylmethyl chloride hydrochloride,unii-bqa8fyp4yn,3-chloromethyl pyridinium chloride,3-chloromethyl pyridine.hcl
IUPAC Name	3-(chloromethyl)pyridine;hydrochloride
InChI Key	UZGLOGCJCWBBIV-UHFFFAOYSA-N
Molecular Formula	C6H7Cl2N

2-Phenoxypropylamine, 98%

CAS: 6437-49-6 Molecular Formula: C9H14ClNO Molecular Weight (g/mol): 187.667 MDL Number: MFCD07781046 InChI Key: CGOBBGUREQJPPH-UHFFFAOYSA-N Synonym: 2-phenoxypropylamine hydrochloride,2-phenoxypropan-1-amine hydrochloride,2-phenoxypropylamine hcl,1-aminopropan-2-yl oxy benzene hydrochloride,acmc-20annz,2-phenoxypropan-1-amine-hydrogen chloride 1/1 PubChem CID: 24212021 IUPAC Name: 2-phenoxypropan-1-amine;hydrochloride SMILES: CC(CN)OC1=CC=CC=C1.Cl

Pricing and Availability
Specifications

PubChem CID	24212021
CAS	6437-49-6
Molecular Weight (g/mol)	187.667
MDL Number	MFCD07781046
SMILES	CC(CN)OC1=CC=CC=C1.Cl
Synonym	2-phenoxypropylamine hydrochloride,2-phenoxypropan-1-amine hydrochloride,2-phenoxypropylamine hcl,1-aminopropan-2-yl oxy benzene hydrochloride,acmc-20annz,2-phenoxypropan-1-amine-hydrogen chloride 1/1
IUPAC Name	2-phenoxypropan-1-amine;hydrochloride
InChI Key	CGOBBGUREQJPPH-UHFFFAOYSA-N
Molecular Formula	C9H14ClNO

6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine dihydrochloride, 97%, Thermo Scientific Chemicals

CAS: 147740-02-1 Molecular Formula: C₇H₈N₂·₂ClH Molecular Weight (g/mol): 193.08 InChI Key: FZBCVKVGLQRBHY-UHFFFAOYSA-N Synonym: 6,7-dihydro-5h-pyrrolo 3,4-b pyridine dihydrochloride,5h,6h,7h-pyrrolo 3,4-b pyridine dihydrochloride,6,7-dihydro-5h-pyrrolo 3,4-b pyridine 2hcl,5h-pyrrolo 3,4-b pyridine, 6,7-dihydro-, dihydrochloride,pubchem18111,acmc-1c7fx,6,7-dihydro-5h-pyrrolo 3,4-b pyridine dihcl,6,7-dihydro-5h-pyrrolo 3,4-b pyridine dihydrochlor,5,7-dihydro-6h-pyrrolo 3,4-b pyridine dihydrochloride PubChem CID: 23503616 IUPAC Name: 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine;dihydrochloride SMILES: C1C2=C(CN1)N=CC=C2.Cl.Cl

Pricing and Availability
Specifications

PubChem CID	23503616
CAS	147740-02-1
Molecular Weight (g/mol)	193.08
SMILES	C1C2=C(CN1)N=CC=C2.Cl.Cl
Synonym	6,7-dihydro-5h-pyrrolo 3,4-b pyridine dihydrochloride,5h,6h,7h-pyrrolo 3,4-b pyridine dihydrochloride,6,7-dihydro-5h-pyrrolo 3,4-b pyridine 2hcl,5h-pyrrolo 3,4-b pyridine, 6,7-dihydro-, dihydrochloride,pubchem18111,acmc-1c7fx,6,7-dihydro-5h-pyrrolo 3,4-b pyridine dihcl,6,7-dihydro-5h-pyrrolo 3,4-b pyridine dihydrochlor,5,7-dihydro-6h-pyrrolo 3,4-b pyridine dihydrochloride
IUPAC Name	6,7-dihydro-5H-pyrrolo[3,4-b]pyridine;dihydrochloride
InChI Key	FZBCVKVGLQRBHY-UHFFFAOYSA-N
Molecular Formula	C₇H₈N₂·₂ClH

Doxepin hydrochloride

CAS: 1229-29-4 Molecular Formula: C19H22ClNO Molecular Weight (g/mol): 315.841 MDL Number: MFCD00079135 InChI Key: MHNSPTUQQIYJOT-SJDTYFKWSA-N Synonym: doxepin hydrochloride,novoxapin,aponal,toruan,curatin,sinequan,zonalon,adapin,doxepine hydrochloride,novoxapin hydrochloride PubChem CID: 6419921 IUPAC Name: (3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride SMILES: CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.Cl

Pricing and Availability
Specifications

PubChem CID	6419921
CAS	1229-29-4
Molecular Weight (g/mol)	315.841
MDL Number	MFCD00079135
SMILES	CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.Cl
Synonym	doxepin hydrochloride,novoxapin,aponal,toruan,curatin,sinequan,zonalon,adapin,doxepine hydrochloride,novoxapin hydrochloride
IUPAC Name	(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride
InChI Key	MHNSPTUQQIYJOT-SJDTYFKWSA-N
Molecular Formula	C19H22ClNO

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