U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C7H9NO
Molecular Weight 123.1525
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Cyanocyclohexanone

SMILES

O=C1CCCCC1C#N

InChI

InChIKey=RWMVCOUKVCLWIC-UHFFFAOYSA-N
InChI=1S/C7H9NO/c8-5-6-3-1-2-4-7(6)9/h6H,1-4H2

HIDE SMILES / InChI

Approval Year

Name Type Language
2-Cyanocyclohexanone
Systematic Name English
α-Cyanocyclohexanone
Systematic Name English
2-Oxocyclohexanecarbonitrile
Systematic Name English
2-Oxocyclohexane-1-carbonitrile
Systematic Name English
Cyclohexanecarbonitrile, 2-oxo-
Systematic Name English
NSC-2841
Code English
Code System Code Type Description
EPA CompTox
DTXSID40277557
Created by admin on Sat Dec 16 19:14:10 GMT 2023 , Edited by admin on Sat Dec 16 19:14:10 GMT 2023
PRIMARY
CAS
4513-77-3
Created by admin on Sat Dec 16 19:14:10 GMT 2023 , Edited by admin on Sat Dec 16 19:14:10 GMT 2023
PRIMARY
PUBCHEM
220297
Created by admin on Sat Dec 16 19:14:10 GMT 2023 , Edited by admin on Sat Dec 16 19:14:10 GMT 2023
PRIMARY
FDA UNII
6F7V86456G
Created by admin on Sat Dec 16 19:14:10 GMT 2023 , Edited by admin on Sat Dec 16 19:14:10 GMT 2023
PRIMARY
NSC
2841
Created by admin on Sat Dec 16 19:14:10 GMT 2023 , Edited by admin on Sat Dec 16 19:14:10 GMT 2023
PRIMARY