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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H12ClNO
Molecular Weight 185.651
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(CHLOROMETHYL)-3,5-DIMETHYL-4-METHOXYPYRIDINE

SMILES

COC1=C(C)C=NC(CCl)=C1C

InChI

InChIKey=SRKVJDYNPSMHJM-UHFFFAOYSA-N
InChI=1S/C9H12ClNO/c1-6-5-11-8(4-10)7(2)9(6)12-3/h5H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H12ClNO
Molecular Weight 185.651
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:41:10 GMT 2023
Edited
by admin
on Sat Dec 16 10:41:10 GMT 2023
Record UNII
NH3A66X6A6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(CHLOROMETHYL)-3,5-DIMETHYL-4-METHOXYPYRIDINE
Systematic Name English
PYRIDINE, 2-(CHLOROMETHYL)-4-METHOXY-3,5-DIMETHYL-
Systematic Name English
2-(CHLOROMETHYL)-4-METHOXY-3,5-DIMETHYLPYRIDINE
Systematic Name English
2-CHLOROMETHYL-3,5-DIMETHYL-4-METHOXYPYRIDINE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70356147
Created by admin on Sat Dec 16 10:41:10 GMT 2023 , Edited by admin on Sat Dec 16 10:41:10 GMT 2023
PRIMARY
CAS
84006-10-0
Created by admin on Sat Dec 16 10:41:10 GMT 2023 , Edited by admin on Sat Dec 16 10:41:10 GMT 2023
PRIMARY
FDA UNII
NH3A66X6A6
Created by admin on Sat Dec 16 10:41:10 GMT 2023 , Edited by admin on Sat Dec 16 10:41:10 GMT 2023
PRIMARY
PUBCHEM
819992
Created by admin on Sat Dec 16 10:41:10 GMT 2023 , Edited by admin on Sat Dec 16 10:41:10 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT