C1CCC(=O)NCC1
CAS: 105-60-2
Name: azepan-2-one
SMILES: C1CCC(=O)NCC1

Molecular Processing

Molecular formula
C6H11NO
Molecular weight
113.16
Exact mass
113.0841
XLogP
0.68
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
31.48

Supplementary Information

InChIKey: JBKVHLHDHHXQEQ-UHFFFAOYSA-N
Synonyme
azepan-2-oneCAPROLACTAM105-60-2epsilon-Caprolactam2-Oxohexamethylenimine6-CaprolactamAminocaproic lactamHexahydro-2H-azepin-2-one6-Hexanelactam2-Oxohexamethyleneimine2-AzacycloheptanoneHexanolactam2H-Azepin-2-one, hexahydro-Hexahydro-2-azepinone2-Perhydroazepinone1,6-HexolactamHexanone isoximeHexanonisoximCaprolattame2-KetohexamethylenimineCyclohexanone iso-oxime2-Ketohexamethyleneimine1-Aza-2-cycloheptanoneCaprolactam monomerEpsylon kaprolaktam6-Aminocaproic acid lactamExtrom 6NKaprominehexannic acidStilon
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