Azepanes

1 – 14 of 14 results

Hexamethyleneimine, 98+%

CAS: 111-49-9 Molecular Formula: C6H13N Molecular Weight (g/mol): 99.177 MDL Number: MFCD00006934 InChI Key: ZSIQJIWKELUFRJ-UHFFFAOYSA-N Synonym: hexamethyleneimine,homopiperidine,hexahydroazepine,hexahydro-1h-azepine,perhydroazepine,1h-azepine, hexahydro,hexamethylenimine,azacycloheptane,azepan,hexamethylene imine PubChem CID: 8119 ChEBI: CHEBI:32616 IUPAC Name: azepane SMILES: C1CCCNCC1

Pricing and Availability
Specifications

PubChem CID	8119
CAS	111-49-9
Molecular Weight (g/mol)	99.177
ChEBI	CHEBI:32616
MDL Number	MFCD00006934
SMILES	C1CCCNCC1
Synonym	hexamethyleneimine,homopiperidine,hexahydroazepine,hexahydro-1h-azepine,perhydroazepine,1h-azepine, hexahydro,hexamethylenimine,azacycloheptane,azepan,hexamethylene imine
IUPAC Name	azepane
InChI Key	ZSIQJIWKELUFRJ-UHFFFAOYSA-N
Molecular Formula	C6H13N

8-Oxa-3-azabicyclo[3.2.1]octane hydrochloride, 97%

CAS: 54745-74-3 Molecular Formula: C6H12ClNO Molecular Weight (g/mol): 149.62 MDL Number: MFCD17926456,MFCD09800611 InChI Key: XADOTNAXKKFKDY-UHFFFAOYNA-N Synonym: 8-oxa-3-azabicyclo 3.2.1 octane hydrochloride,8-oxa-3-azabicyclo 3,2,1 octane hydrochloride,8-oxa-3-azabicyclo 3.2.1 octane hcl,8-oxa-3-azabicyclo 3.2.1 octanehydrochloride,8-oxa-3-azabicyclo 3.2.1 octane, hydrochloride,8-oxa-3-aza-bicyclo 3.2.1 octane hydrochloride,8-oxa-3-azabicyclooctane hydrochloride,8-oxa-3-azabicyclo 3.2.1 octane-hcl,8-oxa-3-aza-bicyclo 3.2.1 octane hcl PubChem CID: 21983536 SMILES: Cl.C1CC2CNCC1O2

Pricing and Availability
Specifications

PubChem CID	21983536
CAS	54745-74-3
Molecular Weight (g/mol)	149.62
MDL Number	MFCD17926456,MFCD09800611
SMILES	Cl.C1CC2CNCC1O2
Synonym	8-oxa-3-azabicyclo 3.2.1 octane hydrochloride,8-oxa-3-azabicyclo 3,2,1 octane hydrochloride,8-oxa-3-azabicyclo 3.2.1 octane hcl,8-oxa-3-azabicyclo 3.2.1 octanehydrochloride,8-oxa-3-azabicyclo 3.2.1 octane, hydrochloride,8-oxa-3-aza-bicyclo 3.2.1 octane hydrochloride,8-oxa-3-azabicyclooctane hydrochloride,8-oxa-3-azabicyclo 3.2.1 octane-hcl,8-oxa-3-aza-bicyclo 3.2.1 octane hcl
InChI Key	XADOTNAXKKFKDY-UHFFFAOYNA-N
Molecular Formula	C6H12ClNO

1,8-Diazabicyclo[5.4.0]undec-7-ene, 98+%

CAS: 6674-22-2 Molecular Formula: C9H16N2 Molecular Weight (g/mol): 152.241 MDL Number: MFCD00006930 InChI Key: GQHTUMJGOHRCHB-UHFFFAOYSA-N Synonym: 1,8-diazabicyclo 5.4.0 undec-7-ene,2,3,4,6,7,8,9,10-octahydropyrimido 1,2-a azepine,polycat dbu,dbu,unii-h1ilj6ibux,pyrimido 1,2-a azepine, 2,3,4,6,7,8,9,10-octahydro,1,8-diazabicyclo 5.4.0-7-undecene,h1ilj6ibux,1,8-diazabicyclo 5,4,0 undec-7-ene PubChem CID: 81184 IUPAC Name: 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine SMILES: C1CCC2=NCCCN2CC1

Pricing and Availability
Specifications

PubChem CID	81184
CAS	6674-22-2
Molecular Weight (g/mol)	152.241
MDL Number	MFCD00006930
SMILES	C1CCC2=NCCCN2CC1
Synonym	1,8-diazabicyclo 5.4.0 undec-7-ene,2,3,4,6,7,8,9,10-octahydropyrimido 1,2-a azepine,polycat dbu,dbu,unii-h1ilj6ibux,pyrimido 1,2-a azepine, 2,3,4,6,7,8,9,10-octahydro,1,8-diazabicyclo 5.4.0-7-undecene,h1ilj6ibux,1,8-diazabicyclo 5,4,0 undec-7-ene
IUPAC Name	2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine
InChI Key	GQHTUMJGOHRCHB-UHFFFAOYSA-N
Molecular Formula	C9H16N2

2-(Hexamethyleneimino)ethyl chloride hydrochloride, 98%, Thermo Scientific Chemicals

CAS: 26487-67-2 Molecular Formula: C8H17Cl2N Molecular Weight (g/mol): 198.131 MDL Number: MFCD00012842 InChI Key: ZQDSOUPBYJIPNM-UHFFFAOYSA-N Synonym: 1-2-chloroethyl azepane hydrochloride,2-hexamethyleneimino ethyl chloride hydrochloride,1h-azepine, hydrochloride,2-chloroethylhexamethylenemine hydrochloride,1-2-chloroethyl hexamethyleneimine hydrochloride,2-chloroethyl hexamethylene imine hydrochloride,2-chloroethyl azaperhydroepine, chloride,pubchem21389,1-2-chloroethyl azepane hcl,wln: t7ntj a2g &gh PubChem CID: 24188283 IUPAC Name: 1-(2-chloroethyl)azepane;hydrochloride SMILES: C1CCCN(CC1)CCCl.Cl

Pricing and Availability
Specifications

PubChem CID	24188283
CAS	26487-67-2
Molecular Weight (g/mol)	198.131
MDL Number	MFCD00012842
SMILES	C1CCCN(CC1)CCCl.Cl
Synonym	1-2-chloroethyl azepane hydrochloride,2-hexamethyleneimino ethyl chloride hydrochloride,1h-azepine, hydrochloride,2-chloroethylhexamethylenemine hydrochloride,1-2-chloroethyl hexamethyleneimine hydrochloride,2-chloroethyl hexamethylene imine hydrochloride,2-chloroethyl azaperhydroepine, chloride,pubchem21389,1-2-chloroethyl azepane hcl,wln: t7ntj a2g &gh
IUPAC Name	1-(2-chloroethyl)azepane;hydrochloride
InChI Key	ZQDSOUPBYJIPNM-UHFFFAOYSA-N
Molecular Formula	C8H17Cl2N

N-(2-Hydroxyethyl)hexamethyleneimine, 95%

CAS: 20603-00-3 Molecular Formula: C8H17NO Molecular Weight (g/mol): 143.23 MDL Number: MFCD00020988 InChI Key: VMRYMOMQCYSPHS-UHFFFAOYSA-N Synonym: 2-azepan-1-yl ethanol,hexahydro-1h-azepine-1-ethanol,n-2-hydroxyethyl hexamethyleneimine,2-azepan-1-yl ethan-1-ol,2-hexamethyleneimino ethanol,2-azaperhydroepinylethan-1-ol,2-azepan-1-ylethan-1-ol,2-azepan-1-yl ;ethanol,2-n-hexamethyleneimino ethanol,1-2-hydroxyethyl homopiperidine PubChem CID: 88615 IUPAC Name: 2-(azepan-1-yl)ethanol SMILES: C1CCCN(CC1)CCO

Pricing and Availability
Specifications

PubChem CID	88615
CAS	20603-00-3
Molecular Weight (g/mol)	143.23
MDL Number	MFCD00020988
SMILES	C1CCCN(CC1)CCO
Synonym	2-azepan-1-yl ethanol,hexahydro-1h-azepine-1-ethanol,n-2-hydroxyethyl hexamethyleneimine,2-azepan-1-yl ethan-1-ol,2-hexamethyleneimino ethanol,2-azaperhydroepinylethan-1-ol,2-azepan-1-ylethan-1-ol,2-azepan-1-yl ;ethanol,2-n-hexamethyleneimino ethanol,1-2-hydroxyethyl homopiperidine
IUPAC Name	2-(azepan-1-yl)ethanol
InChI Key	VMRYMOMQCYSPHS-UHFFFAOYSA-N
Molecular Formula	C8H17NO

1,8-Diazabicyclo[5.4.0]undec-7-ene, 98+%

CAS: 6674-22-2 MDL Number: MFCD00006930 InChI Key: GQHTUMJGOHRCHB-UHFFFAOYSA-N Synonym: 1,8-diazabicyclo 5.4.0 undec-7-ene,2,3,4,6,7,8,9,10-octahydropyrimido 1,2-a azepine,polycat dbu,dbu,unii-h1ilj6ibux,pyrimido 1,2-a azepine, 2,3,4,6,7,8,9,10-octahydro,1,8-diazabicyclo 5.4.0-7-undecene,h1ilj6ibux,1,8-diazabicyclo 5,4,0 undec-7-ene PubChem CID: 81184 IUPAC Name: 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine SMILES: C1CCC2=NCCCN2CC1

Pricing and Availability
Specifications

PubChem CID	81184
CAS	6674-22-2
MDL Number	MFCD00006930
SMILES	C1CCC2=NCCCN2CC1
Synonym	1,8-diazabicyclo 5.4.0 undec-7-ene,2,3,4,6,7,8,9,10-octahydropyrimido 1,2-a azepine,polycat dbu,dbu,unii-h1ilj6ibux,pyrimido 1,2-a azepine, 2,3,4,6,7,8,9,10-octahydro,1,8-diazabicyclo 5.4.0-7-undecene,h1ilj6ibux,1,8-diazabicyclo 5,4,0 undec-7-ene
IUPAC Name	2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine
InChI Key	GQHTUMJGOHRCHB-UHFFFAOYSA-N

Hexamethyleneimine, 99%

CAS: 111-49-9 Molecular Formula: C₆H₁₃N Molecular Weight (g/mol): 99.17 MDL Number: MFCD00006934 InChI Key: ZSIQJIWKELUFRJ-UHFFFAOYSA-N Synonym: hexamethyleneimine,homopiperidine,hexahydroazepine,hexahydro-1h-azepine,perhydroazepine,1h-azepine, hexahydro,hexamethylenimine,azacycloheptane,azepan,hexamethylene imine PubChem CID: 8119 ChEBI: CHEBI:32616 IUPAC Name: azepane SMILES: C1CCCNCC1

Pricing and Availability
Specifications

PubChem CID	8119
CAS	111-49-9
Molecular Weight (g/mol)	99.17
ChEBI	CHEBI:32616
MDL Number	MFCD00006934
SMILES	C1CCCNCC1
Synonym	hexamethyleneimine,homopiperidine,hexahydroazepine,hexahydro-1h-azepine,perhydroazepine,1h-azepine, hexahydro,hexamethylenimine,azacycloheptane,azepan,hexamethylene imine
IUPAC Name	azepane
InChI Key	ZSIQJIWKELUFRJ-UHFFFAOYSA-N
Molecular Formula	C₆H₁₃N

Phthalimide DBU Salt 98.0+%, TCI America™

CAS: 119812-51-0 Molecular Formula: C17H21N3O2 Molecular Weight (g/mol): 299.374 MDL Number: MFCD00191683 InChI Key: BLFUSYFCQXDQCF-UHFFFAOYSA-N Synonym: DBU Phthalimide Salt, Phthalimide 1,8-Diazabicyclo[5.4.0]undec-7-ene Salt PubChem CID: 14331607 IUPAC Name: isoindole-1,3-dione;2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine SMILES: C1CCC2=NCCCN2CC1.C1=CC=C2C(=C1)C(=O)NC2=O

Pricing and Availability
Specifications

PubChem CID	14331607
CAS	119812-51-0
Molecular Weight (g/mol)	299.374
MDL Number	MFCD00191683
SMILES	C1CCC2=NCCCN2CC1.C1=CC=C2C(=C1)C(=O)NC2=O
Synonym	DBU Phthalimide Salt, Phthalimide 1,8-Diazabicyclo[5.4.0]undec-7-ene Salt
IUPAC Name	isoindole-1,3-dione;2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine
InChI Key	BLFUSYFCQXDQCF-UHFFFAOYSA-N
Molecular Formula	C17H21N3O2

Azelastine Hydrochloride 98.0+%, TCI America™

CAS: 79307-93-0 Molecular Formula: C22H25Cl2N3O Molecular Weight (g/mol): 418.36 MDL Number: MFCD00242783 InChI Key: YEJAJYAHJQIWNU-UHFFFAOYNA-N Synonym: 4-(4-Chlorobenzyl)-2-(1-methylazepan-4-yl)-1-phthalazinone Hydrochloride PubChem CID: 50986914 ChEBI: CHEBI:2951 IUPAC Name: hydrogen 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)-1,2-dihydrophthalazin-1-one chloride SMILES: [H+].[Cl-].CN1CCCC(CC1)N1N=C(CC2=CC=C(Cl)C=C2)C2=CC=CC=C2C1=O

Pricing and Availability
Specifications

PubChem CID	50986914
CAS	79307-93-0
Molecular Weight (g/mol)	418.36
ChEBI	CHEBI:2951
MDL Number	MFCD00242783
SMILES	[H+].[Cl-].CN1CCCC(CC1)N1N=C(CC2=CC=C(Cl)C=C2)C2=CC=CC=C2C1=O
Synonym	4-(4-Chlorobenzyl)-2-(1-methylazepan-4-yl)-1-phthalazinone Hydrochloride
IUPAC Name	hydrogen 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)-1,2-dihydrophthalazin-1-one chloride
InChI Key	YEJAJYAHJQIWNU-UHFFFAOYNA-N
Molecular Formula	C22H25Cl2N3O

PubChem CID	8119
CAS	111-49-9
Molecular Weight (g/mol)	99.177
ChEBI	CHEBI:32616
MDL Number	MFCD00006934
SMILES	C1CCCNCC1
Synonym	hexamethyleneimine,homopiperidine,hexahydroazepine,hexahydro-1h-azepine,perhydroazepine,1h-azepine, hexahydro,hexamethylenimine,azacycloheptane,azepan,hexamethylene imine
IUPAC Name	azepane
InChI Key	ZSIQJIWKELUFRJ-UHFFFAOYSA-N
Molecular Formula	C6H13N

Hexamethyleneammonium Hexamethylenedithiocarbamate 97.0+%, TCI America™

CAS: 2608-11-9 Molecular Formula: C13H26N2S2 Molecular Weight (g/mol): 274.49 MDL Number: MFCD00036327 InChI Key: CIPHOUPBLAOEKY-UHFFFAOYSA-N Synonym: Hexamethylenedithiocarbamic Acid Hexamethyleneammonium Salt PubChem CID: 164998 IUPAC Name: azepane;azepane-1-carbodithioic acid SMILES: C1CCCNCC1.C1CCCN(CC1)C(=S)S

Pricing and Availability
Specifications

PubChem CID	164998
CAS	2608-11-9
Molecular Weight (g/mol)	274.49
MDL Number	MFCD00036327
SMILES	C1CCCNCC1.C1CCCN(CC1)C(=S)S
Synonym	Hexamethylenedithiocarbamic Acid Hexamethyleneammonium Salt
IUPAC Name	azepane;azepane-1-carbodithioic acid
InChI Key	CIPHOUPBLAOEKY-UHFFFAOYSA-N
Molecular Formula	C13H26N2S2

1,8-Diazabicyclo[5.4.0]-7-undecene 98.0+%, TCI America™

Pricing and Availability
Specifications

PubChem CID	81184
CAS	6674-22-2
Molecular Weight (g/mol)	152.241
MDL Number	MFCD00006930
SMILES	C1CCC2=NCCCN2CC1
Synonym	1,8-diazabicyclo 5.4.0 undec-7-ene,2,3,4,6,7,8,9,10-octahydropyrimido 1,2-a azepine,polycat dbu,dbu,unii-h1ilj6ibux,pyrimido 1,2-a azepine, 2,3,4,6,7,8,9,10-octahydro,1,8-diazabicyclo 5.4.0-7-undecene,h1ilj6ibux,1,8-diazabicyclo 5,4,0 undec-7-ene
IUPAC Name	2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine
InChI Key	GQHTUMJGOHRCHB-UHFFFAOYSA-N
Molecular Formula	C9H16N2

1-(2-Chloroethyl)-1H-hexahydroazepine Hydrochloride 98.0+%, TCI America™

Pricing and Availability
Specifications

PubChem CID	24188283
CAS	26487-67-2
Molecular Weight (g/mol)	198.131
MDL Number	MFCD00012842
SMILES	C1CCCN(CC1)CCCl.Cl
Synonym	1-2-chloroethyl azepane hydrochloride,2-hexamethyleneimino ethyl chloride hydrochloride,1h-azepine, hydrochloride,2-chloroethylhexamethylenemine hydrochloride,1-2-chloroethyl hexamethyleneimine hydrochloride,2-chloroethyl hexamethylene imine hydrochloride,2-chloroethyl azaperhydroepine, chloride,pubchem21389,1-2-chloroethyl azepane hcl,wln: t7ntj a2g &gh
IUPAC Name	1-(2-chloroethyl)azepane;hydrochloride
InChI Key	ZQDSOUPBYJIPNM-UHFFFAOYSA-N
Molecular Formula	C8H17Cl2N

epsilon-Thiocaprolactam 98.0+%, TCI America™

CAS: 7203-96-5 Molecular Formula: C6H11NS Molecular Weight (g/mol): 129.221 MDL Number: MFCD00006937 InChI Key: APLHDUWNMGJBFD-UHFFFAOYSA-N Synonym: Hexahydro-2-azepinethione, 2-Thioxohexamethyleneimine PubChem CID: 3003736 IUPAC Name: azepane-2-thione SMILES: C1CCC(=S)NCC1

Pricing and Availability
Specifications

PubChem CID	3003736
CAS	7203-96-5
Molecular Weight (g/mol)	129.221
MDL Number	MFCD00006937
SMILES	C1CCC(=S)NCC1
Synonym	Hexahydro-2-azepinethione, 2-Thioxohexamethyleneimine
IUPAC Name	azepane-2-thione
InChI Key	APLHDUWNMGJBFD-UHFFFAOYSA-N
Molecular Formula	C6H11NS

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