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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H6N2
Molecular Weight 118.1359
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-METHYLNICOTINONITRILE

SMILES

CC1=CC(=CN=C1)C#N

InChI

InChIKey=VDWQWOXVBXURMT-UHFFFAOYSA-N
InChI=1S/C7H6N2/c1-6-2-7(3-8)5-9-4-6/h2,4-5H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Patents

Patents

20030018197
1
Name Type Language
5-METHYLNICOTINONITRILE
Systematic Name English
NICOTINONITRILE, 5-METHYL-
Systematic Name English
3-CYANO-5-METHYLPYRIDINE
Systematic Name English
5-CYANO-3-METHYLPYRIDINE
Systematic Name English
5-METHYL-3-PYRIDINECARBONITRILE
Systematic Name English
3-METHYL-5-CYANOPYRIDINE
Systematic Name English
3-PYRIDINECARBONITRILE, 5-METHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
637838
Created by admin on Fri Dec 15 18:08:00 GMT 2023 , Edited by admin on Fri Dec 15 18:08:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID30962768
Created by admin on Fri Dec 15 18:08:00 GMT 2023 , Edited by admin on Fri Dec 15 18:08:00 GMT 2023
PRIMARY
ECHA (EC/EINECS)
255-988-8
Created by admin on Fri Dec 15 18:08:00 GMT 2023 , Edited by admin on Fri Dec 15 18:08:00 GMT 2023
PRIMARY
FDA UNII
15462UXN1X
Created by admin on Fri Dec 15 18:08:00 GMT 2023 , Edited by admin on Fri Dec 15 18:08:00 GMT 2023
PRIMARY
CAS
42885-14-3
Created by admin on Fri Dec 15 18:08:00 GMT 2023 , Edited by admin on Fri Dec 15 18:08:00 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966