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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O2
Molecular Weight 192.2542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLBENZOIC ACID BUTYL ESTER

SMILES

CCCCOC(=O)C1=CC=C(C)C=C1

InChI

InChIKey=UYGHRCCJWWYXMY-UHFFFAOYSA-N
InChI=1S/C12H16O2/c1-3-4-9-14-12(13)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H16O2
Molecular Weight 192.2542
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 12:36:15 GMT 2023
Edited
by admin
on Sat Dec 16 12:36:15 GMT 2023
Record UNII
PJW7Q3ONM1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-METHYLBENZOIC ACID BUTYL ESTER
Systematic Name English
P-TOLUIC ACID, BUTYL ESTER
Systematic Name English
BENZOIC ACID, 4-METHYL-, BUTYL ESTER
Systematic Name English
O-TOLUIC ACID 2-BUTYL ESTER
Common Name English
NSC-24770
Code English
P-METHYLBENZOIC ACID BUTYL ESTER
Common Name English
N-BUTYL P-METHYLBENZOATE
Common Name English
BUTYL P-TOLUATE
Common Name English
BUTYL 4-METHYLBENZOATE
Systematic Name English
BUTYL P-METHYLBENZOATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID3066475
Created by admin on Sat Dec 16 12:36:15 GMT 2023 , Edited by admin on Sat Dec 16 12:36:15 GMT 2023
PRIMARY
FDA UNII
PJW7Q3ONM1
Created by admin on Sat Dec 16 12:36:15 GMT 2023 , Edited by admin on Sat Dec 16 12:36:15 GMT 2023
PRIMARY
NSC
24770
Created by admin on Sat Dec 16 12:36:15 GMT 2023 , Edited by admin on Sat Dec 16 12:36:15 GMT 2023
PRIMARY
PUBCHEM
87994
Created by admin on Sat Dec 16 12:36:15 GMT 2023 , Edited by admin on Sat Dec 16 12:36:15 GMT 2023
PRIMARY
CAS
19277-56-6
Created by admin on Sat Dec 16 12:36:15 GMT 2023 , Edited by admin on Sat Dec 16 12:36:15 GMT 2023
PRIMARY