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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H12O2
Molecular Weight 212.2439
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-CRESOL BENZOATE

SMILES

CC1=CC=C(OC(=O)C2=CC=CC=C2)C=C1

InChI

InChIKey=LLRZUDIHEZXFGV-UHFFFAOYSA-N
InChI=1S/C14H12O2/c1-11-7-9-13(10-8-11)16-14(15)12-5-3-2-4-6-12/h2-10H,1H3

HIDE SMILES / InChI

Molecular Formula C14H12O2
Molecular Weight 212.2439
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 08:02:48 GMT 2023
Edited
by admin
on Sat Dec 16 08:02:48 GMT 2023
Record UNII
TRF6AI5R4X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-CRESOL BENZOATE
Systematic Name English
BENZOIC ACID, 4-METHYLPHENYL ESTER
Systematic Name English
4-METHYLPHENYL BENZOATE
Systematic Name English
BENZOIC ACID, P-TOLYL ESTER
Systematic Name English
NSC-137593
Code English
4-09-00-00306 (BEILSTEIN HANDBOOK REFERENCE)
Common Name English
NSC-8788
Code English
4-CRESYL BENZOATE
Systematic Name English
P-METHYLPHENYL BENZOATE
Systematic Name English
P-CRESYL BENZOATE
Systematic Name English
P-TOLYL BENZOATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID6060632
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY
NSC
8788
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY
FDA UNII
TRF6AI5R4X
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY
CAS
614-34-6
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY
NSC
137593
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-380-1
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY
PUBCHEM
11962
Created by admin on Sat Dec 16 08:02:48 GMT 2023 , Edited by admin on Sat Dec 16 08:02:48 GMT 2023
PRIMARY