Organochlorides

Organic compounds that contain one or more chlorine atoms.

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n-Butyl Chloride (HPLC), Fisher Chemical™

CAS: 109-69-3 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.57 InChI Key: VFWCMGCRMGJXDK-UHFFFAOYSA-N Synonym: butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane PubChem CID: 8005 IUPAC Name: 1-chlorobutane SMILES: CCCCCl

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PubChem CID	8005
CAS	109-69-3
Molecular Weight (g/mol)	92.57
SMILES	CCCCCl
Synonym	butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane
IUPAC Name	1-chlorobutane
InChI Key	VFWCMGCRMGJXDK-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

Trichloroethylene, ACS, 99.5% min

CAS: 79-01-6 Molecular Formula: C2HCl3 Molecular Weight (g/mol): 131.38 MDL Number: MFCD00000838 InChI Key: XSTXAVWGXDQKEL-UHFFFAOYSA-N Synonym: trichloroethylene,trichloroethene,ethene, trichloro,trilene,trichlorethylene,ethinyl trichloride,ethylene trichloride,acetylene trichloride,chlorilen,narcogen PubChem CID: 6575 ChEBI: CHEBI:16602 IUPAC Name: 1,1,2-trichloroethene SMILES: C(=C(Cl)Cl)Cl

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PubChem CID	6575
CAS	79-01-6
Molecular Weight (g/mol)	131.38
ChEBI	CHEBI:16602
MDL Number	MFCD00000838
SMILES	C(=C(Cl)Cl)Cl
Synonym	trichloroethylene,trichloroethene,ethene, trichloro,trilene,trichlorethylene,ethinyl trichloride,ethylene trichloride,acetylene trichloride,chlorilen,narcogen
IUPAC Name	1,1,2-trichloroethene
InChI Key	XSTXAVWGXDQKEL-UHFFFAOYSA-N
Molecular Formula	C2HCl3

Benzyl chloroformate, 95%, stab. with ca 0.1% sodium carbonate

CAS: 501-53-1 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00000640 InChI Key: HSDAJNMJOMSNEV-UHFFFAOYSA-N Synonym: benzyl chloroformate,carbobenzoxy chloride,benzyl chlorocarbonate,cbz chloride,benzyloxycarbonyl chloride,carbobenzyloxy chloride,carbonochloridic acid, phenylmethyl ester,benzylcarbonyl chloride,cbz-cl,chloroformic acid, benzyl ester PubChem CID: 10387 IUPAC Name: benzyl carbonochloridate SMILES: C1=CC=C(C=C1)COC(=O)Cl

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PubChem CID	10387
CAS	501-53-1
Molecular Weight (g/mol)	170.592
MDL Number	MFCD00000640
SMILES	C1=CC=C(C=C1)COC(=O)Cl
Synonym	benzyl chloroformate,carbobenzoxy chloride,benzyl chlorocarbonate,cbz chloride,benzyloxycarbonyl chloride,carbobenzyloxy chloride,carbonochloridic acid, phenylmethyl ester,benzylcarbonyl chloride,cbz-cl,chloroformic acid, benzyl ester
IUPAC Name	benzyl carbonochloridate
InChI Key	HSDAJNMJOMSNEV-UHFFFAOYSA-N
Molecular Formula	C8H7ClO2

1-Chloro-3-methyl-2-butene, 95%, stab. with potassium carbonate

CAS: 503-60-6 Molecular Formula: C5H9Cl Molecular Weight (g/mol): 104.577 MDL Number: MFCD00000982 InChI Key: JKXQKGNGJVZKFA-UHFFFAOYSA-N Synonym: 1-chloro-3-methyl-2-butene,prenyl chloride,2-butene, 1-chloro-3-methyl,3,3-dimethylallyl chloride,3-methyl-2-butenyl chloride,3-methylcrotyl chloride,unii-kmt7v9llbr,gamma,gamma-dimethylallyl chloride,kmt7v9llbr,.gamma.,.gamma.-dimethylallyl chloride PubChem CID: 10429 IUPAC Name: 1-chloro-3-methylbut-2-ene SMILES: CC(=CCCl)C

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PubChem CID	10429
CAS	503-60-6
Molecular Weight (g/mol)	104.577
MDL Number	MFCD00000982
SMILES	CC(=CCCl)C
Synonym	1-chloro-3-methyl-2-butene,prenyl chloride,2-butene, 1-chloro-3-methyl,3,3-dimethylallyl chloride,3-methyl-2-butenyl chloride,3-methylcrotyl chloride,unii-kmt7v9llbr,gamma,gamma-dimethylallyl chloride,kmt7v9llbr,.gamma.,.gamma.-dimethylallyl chloride
IUPAC Name	1-chloro-3-methylbut-2-ene
InChI Key	JKXQKGNGJVZKFA-UHFFFAOYSA-N
Molecular Formula	C5H9Cl

cis-1,4-Dichloro-2-butene, 95%

CAS: 1476-11-5 Molecular Formula: C4H6Cl2 MDL Number: MFCD00062950 InChI Key: FQDIANVAWVHZIR-UPHRSURJSA-N Synonym: cis-1,4-dichloro-2-butene,z-1,4-dichlorobut-2-ene,1,4-dichloro-cis-2-butene,2-butene, 1,4-dichloro-, z,cis-1,4-dichlorobut-2-ene,unii-bqs2752i90,ccris 2651,cis 1,4-dichlorobutene,2-butene, 1,4-dichloro-, cis,cis-2,3-dichlorobut-2-ene PubChem CID: 6432115 IUPAC Name: (Z)-1,4-dichlorobut-2-ene

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PubChem CID	6432115
CAS	1476-11-5
MDL Number	MFCD00062950
Synonym	cis-1,4-dichloro-2-butene,z-1,4-dichlorobut-2-ene,1,4-dichloro-cis-2-butene,2-butene, 1,4-dichloro-, z,cis-1,4-dichlorobut-2-ene,unii-bqs2752i90,ccris 2651,cis 1,4-dichlorobutene,2-butene, 1,4-dichloro-, cis,cis-2,3-dichlorobut-2-ene
IUPAC Name	(Z)-1,4-dichlorobut-2-ene
InChI Key	FQDIANVAWVHZIR-UPHRSURJSA-N
Molecular Formula	C4H6Cl2

4-Chlorobutyronitrile, 97%

CAS: 628-20-6 Molecular Formula: C4H6ClN Molecular Weight (g/mol): 103.55 MDL Number: MFCD00001972 InChI Key: ZFCFBWSVQWGOJJ-UHFFFAOYSA-N Synonym: 4-chlorobutyronitrile,butanenitrile, 4-chloro,butyronitrile, 4-chloro,gamma-chlorobutyronitrile,1-chloro-3-cyanopropane,4-chloro-butyronitrile,.gamma.-chlorobutyronitrile,4chlorobutyronitrile,4-chlorobutyroonitrile,4-chloro-butanenitrile PubChem CID: 12336 IUPAC Name: 4-chlorobutanenitrile SMILES: ClCCCC#N

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Specifications

PubChem CID	12336
CAS	628-20-6
Molecular Weight (g/mol)	103.55
MDL Number	MFCD00001972
SMILES	ClCCCC#N
Synonym	4-chlorobutyronitrile,butanenitrile, 4-chloro,butyronitrile, 4-chloro,gamma-chlorobutyronitrile,1-chloro-3-cyanopropane,4-chloro-butyronitrile,.gamma.-chlorobutyronitrile,4chlorobutyronitrile,4-chlorobutyroonitrile,4-chloro-butanenitrile
IUPAC Name	4-chlorobutanenitrile
InChI Key	ZFCFBWSVQWGOJJ-UHFFFAOYSA-N
Molecular Formula	C4H6ClN

Tetrachloroethylene, 99%

CAS: 127-18-4 Molecular Formula: C2Cl4 Molecular Weight (g/mol): 165.82 MDL Number: MFCD00000834 InChI Key: CYTYCFOTNPOANT-UHFFFAOYSA-N Synonym: tetrachloroethylene,tetrachloroethene,perchloroethylene,perchlorethylene,perc,ethene, tetrachloro,tetrachlorethylene,ethylene tetrachloride,carbon dichloride,ankilostin PubChem CID: 31373 ChEBI: CHEBI:17300 SMILES: ClC(Cl)=C(Cl)Cl

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Specifications

PubChem CID	31373
CAS	127-18-4
Molecular Weight (g/mol)	165.82
ChEBI	CHEBI:17300
MDL Number	MFCD00000834
SMILES	ClC(Cl)=C(Cl)Cl
Synonym	tetrachloroethylene,tetrachloroethene,perchloroethylene,perchlorethylene,perc,ethene, tetrachloro,tetrachlorethylene,ethylene tetrachloride,carbon dichloride,ankilostin
InChI Key	CYTYCFOTNPOANT-UHFFFAOYSA-N
Molecular Formula	C2Cl4

1,2-Dibromotetrachloroethane, 97%

CAS: 630-25-1 Molecular Formula: C2Br2Cl4 Molecular Weight (g/mol): 325.63 MDL Number: MFCD00000780 InChI Key: WJUKOGPNGRUXMG-UHFFFAOYSA-N Synonym: 1,2-dibromotetrachloroethane,dbtce,sym-dibromotetrachloroethane,ethane, 1,2-dibromo-1,1,2,2-tetrachloro,unii-0sgg217efr,0sgg217efr,1,2-dibrom-1,1,2,2-tetrachlorethan,brccl2ccl2br,1,2-dibromotetrachloroethan,1,2-dibrom-tetrachlorethane PubChem CID: 69426 IUPAC Name: 1,2-dibromo-1,1,2,2-tetrachloroethane SMILES: C(C(Cl)(Cl)Br)(Cl)(Cl)Br

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Specifications

PubChem CID	69426
CAS	630-25-1
Molecular Weight (g/mol)	325.63
MDL Number	MFCD00000780
SMILES	C(C(Cl)(Cl)Br)(Cl)(Cl)Br
Synonym	1,2-dibromotetrachloroethane,dbtce,sym-dibromotetrachloroethane,ethane, 1,2-dibromo-1,1,2,2-tetrachloro,unii-0sgg217efr,0sgg217efr,1,2-dibrom-1,1,2,2-tetrachlorethan,brccl2ccl2br,1,2-dibromotetrachloroethan,1,2-dibrom-tetrachlorethane
IUPAC Name	1,2-dibromo-1,1,2,2-tetrachloroethane
InChI Key	WJUKOGPNGRUXMG-UHFFFAOYSA-N
Molecular Formula	C2Br2Cl4

1,3-Dichloropropane, 95%

CAS: 142-28-9 Molecular Formula: C3H6Cl2 Molecular Weight (g/mol): 112.981 MDL Number: MFCD00000999 InChI Key: YHRUOJUYPBUZOS-UHFFFAOYSA-N Synonym: trimethylene dichloride,propane, 1,3-dichloro,trimethylene chloride,1,3-dichloro-propane,unii-aj1hq2gucp,ccris 9220,ch2clch2ch2cl,aj1hq2gucp,cl ch2 3cl,1,3-dichlorpropan PubChem CID: 8881 IUPAC Name: 1,3-dichloropropane SMILES: C(CCl)CCl

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Specifications

PubChem CID	8881
CAS	142-28-9
Molecular Weight (g/mol)	112.981
MDL Number	MFCD00000999
SMILES	C(CCl)CCl
Synonym	trimethylene dichloride,propane, 1,3-dichloro,trimethylene chloride,1,3-dichloro-propane,unii-aj1hq2gucp,ccris 9220,ch2clch2ch2cl,aj1hq2gucp,cl ch2 3cl,1,3-dichlorpropan
IUPAC Name	1,3-dichloropropane
InChI Key	YHRUOJUYPBUZOS-UHFFFAOYSA-N
Molecular Formula	C3H6Cl2

2-(Chloromethyl)benzothiazole, 95%

CAS: 37859-43-1 Molecular Formula: C8H6ClNS Molecular Weight (g/mol): 183.65 MDL Number: MFCD05664944 InChI Key: SERUZNHRWBXDOX-UHFFFAOYSA-N Synonym: 2-chloromethyl-1,3-benzothiazole,2-chloromethyl benzothiazole,2-chloromethyl benzo d thiazole,benzothiazole, 2-chloromethyl,2-chloromethylbenzothiazole,2-chloromethyl-benzothiazole,2-chloromethylbenzthiazole,acmc-1ag8v,ksc776s1l,2-chloromethylbenzo d thiazole PubChem CID: 304978 IUPAC Name: 2-(chloromethyl)-1,3-benzothiazole SMILES: ClCC1=NC2=CC=CC=C2S1

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Specifications

PubChem CID	304978
CAS	37859-43-1
Molecular Weight (g/mol)	183.65
MDL Number	MFCD05664944
SMILES	ClCC1=NC2=CC=CC=C2S1
Synonym	2-chloromethyl-1,3-benzothiazole,2-chloromethyl benzothiazole,2-chloromethyl benzo d thiazole,benzothiazole, 2-chloromethyl,2-chloromethylbenzothiazole,2-chloromethyl-benzothiazole,2-chloromethylbenzthiazole,acmc-1ag8v,ksc776s1l,2-chloromethylbenzo d thiazole
IUPAC Name	2-(chloromethyl)-1,3-benzothiazole
InChI Key	SERUZNHRWBXDOX-UHFFFAOYSA-N
Molecular Formula	C8H6ClNS

1-Chlorohexadecane, 97%

CAS: 4860-03-1 MDL Number: MFCD00000959

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Specifications

CAS	4860-03-1
MDL Number	MFCD00000959

Cholesteryl chloroformate, Thermo Scientific Chemicals

CAS: 7144-08-3 MDL Number: MFCD00003633

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Specifications

CAS	7144-08-3
MDL Number	MFCD00003633

3-Chloropropionitrile, 98%

CAS: 542-76-7 Molecular Formula: C3H4ClN Molecular Weight (g/mol): 89.52 MDL Number: MFCD00001952 InChI Key: GNHMRTZZNHZDDM-UHFFFAOYSA-N Synonym: 3-chloropropionitrile,propanenitrile, 3-chloro,3-chloropropiononitrile,1-chloro-2-cyanoethane,3-chloropropanonitrile,3-chlorpropannitril,propionitrile, 3-chloro,beta-chloropropionitrile,usaf a-8798,rcra waste number p027 PubChem CID: 10963 IUPAC Name: 3-chloropropanenitrile SMILES: ClCCC#N

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Specifications

PubChem CID	10963
CAS	542-76-7
Molecular Weight (g/mol)	89.52
MDL Number	MFCD00001952
SMILES	ClCCC#N
Synonym	3-chloropropionitrile,propanenitrile, 3-chloro,3-chloropropiononitrile,1-chloro-2-cyanoethane,3-chloropropanonitrile,3-chlorpropannitril,propionitrile, 3-chloro,beta-chloropropionitrile,usaf a-8798,rcra waste number p027
IUPAC Name	3-chloropropanenitrile
InChI Key	GNHMRTZZNHZDDM-UHFFFAOYSA-N
Molecular Formula	C3H4ClN

4-Chloro-1-methylpiperidine hydrochloride, 97%

CAS: 5382-23-0 Molecular Formula: C6H13Cl2N Molecular Weight (g/mol): 170.077 MDL Number: MFCD00012834 InChI Key: QDOJNWFOCOWAPO-UHFFFAOYSA-N Synonym: 4-chloro-1-methylpiperidine hydrochloride,1-methyl-4-chloropiperidine hydrochloride,4-chloro-n-methylpiperidine hydrochloride,4-chloro-1-methylpiperidinium chloride,piperidine, 4-chloro-1-methyl-, hydrochloride,n-methyl-4-chloropiperidine hydrochloride,1-methyl-4-chloro piperidine,pubchem2461,acmc-1apdo,ksc495i8n PubChem CID: 3034158 IUPAC Name: 4-chloro-1-methylpiperidine;hydrochloride SMILES: CN1CCC(CC1)Cl.Cl

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Specifications

PubChem CID	3034158
CAS	5382-23-0
Molecular Weight (g/mol)	170.077
MDL Number	MFCD00012834
SMILES	CN1CCC(CC1)Cl.Cl
Synonym	4-chloro-1-methylpiperidine hydrochloride,1-methyl-4-chloropiperidine hydrochloride,4-chloro-n-methylpiperidine hydrochloride,4-chloro-1-methylpiperidinium chloride,piperidine, 4-chloro-1-methyl-, hydrochloride,n-methyl-4-chloropiperidine hydrochloride,1-methyl-4-chloro piperidine,pubchem2461,acmc-1apdo,ksc495i8n
IUPAC Name	4-chloro-1-methylpiperidine;hydrochloride
InChI Key	QDOJNWFOCOWAPO-UHFFFAOYSA-N
Molecular Formula	C6H13Cl2N

Ethyl chloroformate, 97%

CAS: 541-41-3 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.521 MDL Number: MFCD00000644 InChI Key: RIFGWPKJUGCATF-UHFFFAOYSA-N Synonym: ethyl chloroformate,ethyl chlorocarbonate,cathyl chloride,ethoxycarbonyl chloride,chloroformic acid ethyl ester,ethylchloroformate,carbonochloridic acid, ethyl ester,chloro ethoxy methanone,ethylchloorformiaat,etil cloroformiato PubChem CID: 10928 IUPAC Name: ethyl carbonochloridate SMILES: CCOC(=O)Cl

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Specifications

PubChem CID	10928
CAS	541-41-3
Molecular Weight (g/mol)	108.521
MDL Number	MFCD00000644
SMILES	CCOC(=O)Cl
Synonym	ethyl chloroformate,ethyl chlorocarbonate,cathyl chloride,ethoxycarbonyl chloride,chloroformic acid ethyl ester,ethylchloroformate,carbonochloridic acid, ethyl ester,chloro ethoxy methanone,ethylchloorformiaat,etil cloroformiato
IUPAC Name	ethyl carbonochloridate
InChI Key	RIFGWPKJUGCATF-UHFFFAOYSA-N
Molecular Formula	C3H5ClO2

Organochlorides

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