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Details

Stereochemistry ACHIRAL
Molecular Formula C9H7NO2
Molecular Weight 161.1574
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CYANOPHENYLACETIC ACID

SMILES

OC(=O)CC1=CC=C(C=C1)C#N

InChI

InChIKey=WEBXRQONNWEETE-UHFFFAOYSA-N
InChI=1S/C9H7NO2/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5H2,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C9H7NO2
Molecular Weight 161.1574
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 11:51:40 GMT 2023
Edited
by admin
on Sat Dec 16 11:51:40 GMT 2023
Record UNII
YJK6AE7K3P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CYANOPHENYLACETIC ACID
Systematic Name English
(P-CYANOPHENYL)ACETIC ACID
Common Name English
4-CYANOBENZENEACETIC ACID
Systematic Name English
BENZENEACETIC ACID, 4-CYANO-
Systematic Name English
NSC-14104
Code English
ACETIC ACID, (P-CYANOPHENYL)-
Common Name English
2-(4-CYANOPHENYL)ACETIC ACID
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00203054
Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023
PRIMARY
CAS
5462-71-5
Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023
PRIMARY
NSC
14104
Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023
PRIMARY
FDA UNII
YJK6AE7K3P
Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023
PRIMARY
PUBCHEM
79587
Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023
PRIMARY
ECHA (EC/EINECS)
226-753-7
Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023
PRIMARY