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

Details

Stereochemistry ABSOLUTE
Molecular Formula C7H14O2
Molecular Weight 130.1849
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ETHYLPENTANOIC ACID, (+)-

SMILES

CCC[C@H](CC)C(O)=O

InChI

InChIKey=BAZMYXGARXYAEQ-LURJTMIESA-N
InChI=1S/C7H14O2/c1-3-5-6(4-2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C7H14O2
Molecular Weight 130.1849
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:58:46 GMT 2023
Edited
by admin
on Sat Dec 16 09:58:46 GMT 2023
Record UNII
L5P3139PDX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-ETHYLPENTANOIC ACID, (+)-
Common Name English
2-ETHYLVALERIC ACID, (+)-
Common Name English
(S)-(+)-2-ETHYLPENTANOIC ACID
Systematic Name English
PENTANOIC ACID, 2-ETHYL-, (2S)-
Systematic Name English
Code System Code Type Description
CAS
727722-15-8
Created by admin on Sat Dec 16 09:58:46 GMT 2023 , Edited by admin on Sat Dec 16 09:58:46 GMT 2023
PRIMARY
PUBCHEM
12729170
Created by admin on Sat Dec 16 09:58:46 GMT 2023 , Edited by admin on Sat Dec 16 09:58:46 GMT 2023
PRIMARY
FDA UNII
L5P3139PDX
Created by admin on Sat Dec 16 09:58:46 GMT 2023 , Edited by admin on Sat Dec 16 09:58:46 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER