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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H13NO
Molecular Weight 163.2163
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ACETYL-4-ISOPROPYLPYRIDINE

SMILES

CC(C)C1=CC(=NC=C1)C(C)=O

InChI

InChIKey=BWJDKYNJXZATRV-UHFFFAOYSA-N
InChI=1S/C10H13NO/c1-7(2)9-4-5-11-10(6-9)8(3)12/h4-7H,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H13NO
Molecular Weight 163.2163
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 01:22:18 GMT 2023
Edited
by admin
on Sat Dec 16 01:22:18 GMT 2023
Record UNII
JRF96H7XWL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-ACETYL-4-ISOPROPYLPYRIDINE
Systematic Name English
FEMA NO. 4638
Code English
ETHANONE, 1-(4-(1-METHYLETHYL)-2-PYRIDINYL)-
Systematic Name English
(4-(1-METHYLETHYL)-2-PYRIDINYL)ETHANONE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 2-ACETYL-4-ISOPROPYLPYRIDINE
Created by admin on Sat Dec 16 01:22:18 GMT 2023 , Edited by admin on Sat Dec 16 01:22:18 GMT 2023
Code System Code Type Description
PUBCHEM
529345
Created by admin on Sat Dec 16 01:22:18 GMT 2023 , Edited by admin on Sat Dec 16 01:22:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID40162212
Created by admin on Sat Dec 16 01:22:18 GMT 2023 , Edited by admin on Sat Dec 16 01:22:18 GMT 2023
PRIMARY
CAS
142896-09-1
Created by admin on Sat Dec 16 01:22:18 GMT 2023 , Edited by admin on Sat Dec 16 01:22:18 GMT 2023
PRIMARY
JECFA MONOGRAPH
2131
Created by admin on Sat Dec 16 01:22:18 GMT 2023 , Edited by admin on Sat Dec 16 01:22:18 GMT 2023
PRIMARY
FDA UNII
JRF96H7XWL
Created by admin on Sat Dec 16 01:22:18 GMT 2023 , Edited by admin on Sat Dec 16 01:22:18 GMT 2023
PRIMARY