Caprolactams

Description:

Cyclic amides of caproic acid. Caproic acid is the carboxylic acid derived from hexane with the general formula C5H11COOH.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Lactams ⮕ Caprolactams

Azepane-2，7-dione
- ≥98%
Cas Number: 4726-93-6 Compound CID: 20849

Formula: C₆H₉NO₂ Molecular Weight: 127.14

IUPAC Name: azepane-2,7-dione

SMILES: C1CCC(=O)NC(=O)C1

InChIKey: OSNDUYDDOHEKEE-UHFFFAOYSA-N

InChI: InChI=1S/C6H9NO2/c8-5-3-1-2-4-6(9)7-5/h1-4H2,(H,7,8,9)
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3-Methylazepan-2-one
- ≥95%
Cas Number: 2073-32-7 EC Number: 864-549-5 Compound CID: 581216

IUPAC Name: 3-methylazepan-2-one

SMILES: CC1CCCCNC1=O

InChIKey: FGSUUFDRDVJCLT-UHFFFAOYSA-N

InChI: InChI=1S/C7H13NO/c1-6-4-2-3-5-8-7(6)9/h6H,2-5H2,1H3,(H,8,9)
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Azone
Cas Number: 59227-89-3

Formula: C₁₈H₃₅NO Molecular Weight: 281.48

IUPAC Name: 1-dodecylazepan-2-one

SMILES: CCCCCCCCCCCCN1CCCCCC1=O

InChIKey: AXTGDCSMTYGJND-UHFFFAOYSA-N

InChI: InChI=1S/C18H35NO/c1-2-3-4-5-6-7-8-9-10-13-16-19-17-14-11-12-15-18(19)20/h2-17H2,1H3

Synonyms: Laurocapram | 1-Dodecylazepan-2-one | N-Dodecyl-ε-caprolactam
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3-(2-Oxoazepan-1-yl)propanenitrile
- ≥97%
Cas Number: 7336-15-4 Compound CID: 10844793

Formula: C₉H₁₄N₂O Molecular Weight: 166.22

IUPAC Name: 3-(2-oxoazepan-1-yl)propanenitrile

SMILES: C1CCC(=O)N(CC1)CCC#N

InChIKey: BATPRUOCWWXKAF-UHFFFAOYSA-N

InChI: InChI=1S/C9H14N2O/c10-6-4-8-11-7-3-1-2-5-9(11)12/h1-5,7-8H2
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1-Benzylazepane-2，5-dione
- ≥95%
Cas Number: 154195-30-9 Compound CID: 46942288

Formula: C₁₃H₁₅NO₂ Molecular Weight: 217.27

IUPAC Name: 1-benzylazepane-2,5-dione

SMILES: C1CC(=O)N(CCC1=O)CC2=CC=CC=C2

InChIKey: CTOCTUGUWVAJRP-UHFFFAOYSA-N

InChI: InChI=1S/C13H15NO2/c15-12-6-7-13(16)14(9-8-12)10-11-4-2-1-3-5-11/h1-5H,6-10H2
Details

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3，3-Dichloroazepan-2-one
- ≥95%
Cas Number: 1709-14-4 Compound CID: 224468

Formula: C₆H₉Cl₂NO Molecular Weight: 182.04

IUPAC Name: 3,3-dichloroazepan-2-one

SMILES: C1CCNC(=O)C(C1)(Cl)Cl

InChIKey: YBOFMSCOQHPFRN-UHFFFAOYSA-N

InChI: InChI=1S/C6H9Cl2NO/c7-6(8)3-1-2-4-9-5(6)10/h1-4H2,(H,9,10)
Details

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6-Azabicyclo[3.2.0]heptan-7-one
- ≥95%
Cas Number: 22031-52-3 Compound CID: 549320

Formula: C₆H₉NO Molecular Weight: 111.14

IUPAC Name: 6-azabicyclo[3.2.0]heptan-7-one

SMILES: C1CC2C(C1)NC2=O

InChIKey: AXDBIGNYXNSBHV-UHFFFAOYSA-N

InChI: InChI=1S/C6H9NO/c8-6-4-2-1-3-5(4)7-6/h4-5H,1-3H2,(H,7,8)
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1-Benzylazepan-2-one
- ≥95%
Cas Number: 33241-96-2 Compound CID: 1491068

Formula: C₁₃H₁₇NO Molecular Weight: 203.28

IUPAC Name: 1-benzylazepan-2-one

SMILES: C1CCC(=O)N(CC1)CC2=CC=CC=C2

InChIKey: DJGIITKNTHQYPX-UHFFFAOYSA-N

InChI: InChI=1S/C13H17NO/c15-13-9-5-2-6-10-14(13)11-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2
Details

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6-hydroxyazepan-2-one
- ≥97%
Cas Number: 1292369-55-1 Compound CID: 67764878

Formula: C₆H₁₁NO₂ Molecular Weight: 129.16

IUPAC Name: 6-hydroxyazepan-2-one

SMILES: C1CC(CNC(=O)C1)O

InChIKey: HEQOFYJVQMAVHS-UHFFFAOYSA-N

InChI: InChI=1S/C6H11NO2/c8-5-2-1-3-6(9)7-4-5/h5,8H,1-4H2,(H,7,9)

Synonyms: 6-Hydroxyazepan-2-one | 1292369-55-1 | 2H-Azepin-2-one, hexahydro-6-hydroxy- | SCHEMBL9068589 | MFCD15529627 | AKOS02...
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3-azatricyclo[4.2.1.0²⁵]non-7-en-4-one
- ≥97%
Cas Number: 14735-70-7 Compound CID: 303980

Formula: C₈H₉NO Molecular Weight: 135.16

IUPAC Name: 3-azatricyclo[4.2.1.02,5]non-7-en-4-one

SMILES: C1C2C=CC1C3C2C(=O)N3

InChIKey: WBZQHVKGKQXWMW-UHFFFAOYSA-N

InChI: InChI=1S/C8H9NO/c10-8-6-4-1-2-5(3-4)7(6)9-8/h1-2,4-7H,3H2,(H,9,10)

Synonyms: 14735-70-7 | 3-Azatricyclo[4.2.1.02,5]non-7-en-4-one | 3-AZA-TRICYCLO[4.2.1.0(2,5)]NON-7-EN-4-ONE | 4-Oxo-3-aza-tricy...
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3-azabicyclo[4.1.0]heptan-2-one
- ≥97%
Cas Number: 31681-11-5 Compound CID: 83814961

Formula: C₆H₉NO Molecular Weight: 111.14

IUPAC Name: 3-azabicyclo[4.1.0]heptan-2-one

SMILES: C1CNC(=O)C2C1C2

InChIKey: ADZAHAGYKIKDBM-UHFFFAOYSA-N

InChI: InChI=1S/C6H9NO/c8-6-5-3-4(5)1-2-7-6/h4-5H,1-3H2,(H,7,8)

Synonyms: 3-Azabicyclo[4.1.0]heptan-2-one | PS-19568 | DTXSID601304897 | SY323638 | MFCD26722596 | EN300-7026027 | SCHEMBL20332...
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3-azabicyclo[3.2.0]heptane-2,4-dione
- ≥97%
Cas Number: 1122-09-4 Compound CID: 352625

Formula: C₆H₇NO₂ Molecular Weight: 125.12

IUPAC Name: 3-azabicyclo[3.2.0]heptane-2,4-dione

SMILES: C1CC2C1C(=O)NC2=O

InChIKey: WXTZWJOCJKKBJR-UHFFFAOYSA-N

InChI: InChI=1S/C6H7NO2/c8-5-3-1-2-4(3)6(9)7-5/h3-4H,1-2H2,(H,7,8,9)

Synonyms: 6TFY3FFP86 | J-500366 | NoName_608 | D72910 | UNII-6TFY3FFP86 | 3-azabicyclo[3.2.0]heptane-2,4-dione | 3-Azabicyclo(3...
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