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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16O2
Molecular Weight 204.2649
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-(CYCLOPENTYLMETHYL)BENZOIC ACID

SMILES

OC(=O)C1=CC=C(CC2CCCC2)C=C1

InChI

InChIKey=PKWZNPSKWPVPGF-UHFFFAOYSA-N
InChI=1S/C13H16O2/c14-13(15)12-7-5-11(6-8-12)9-10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,14,15)

HIDE SMILES / InChI

Molecular Formula C13H16O2
Molecular Weight 204.2649
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 Tue Apr 01 20:01:33 GMT 2025
Edited
by admin
on Tue Apr 01 20:01:33 GMT 2025
Record UNII
W7YHJ6ZM7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-(CYCLOPENTYLMETHYL)BENZOIC ACID
Systematic Name English
NSC-169033
Preferred Name English
4-(CYCLOPENTYLMETHYL)BENZOIC ACID
Systematic Name English
BENZOIC ACID, 4-(CYCLOPENTYLMETHYL)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40191305
Created by admin on Tue Apr 01 20:01:33 GMT 2025 , Edited by admin on Tue Apr 01 20:01:33 GMT 2025
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FDA UNII
W7YHJ6ZM7Z
Created by admin on Tue Apr 01 20:01:33 GMT 2025 , Edited by admin on Tue Apr 01 20:01:33 GMT 2025
PRIMARY
CAS
37874-97-8
Created by admin on Tue Apr 01 20:01:33 GMT 2025 , Edited by admin on Tue Apr 01 20:01:33 GMT 2025
PRIMARY
PUBCHEM
37846
Created by admin on Tue Apr 01 20:01:33 GMT 2025 , Edited by admin on Tue Apr 01 20:01:33 GMT 2025
PRIMARY
NSC
169033
Created by admin on Tue Apr 01 20:01:33 GMT 2025 , Edited by admin on Tue Apr 01 20:01:33 GMT 2025
PRIMARY