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Details

Stereochemistry ACHIRAL
Molecular Formula C14H20O2
Molecular Weight 220.3074
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Methylphenyl heptanoate

SMILES

CCCCCCC(=O)OC1=CC=C(C)C=C1

InChI

InChIKey=AGWLNVFDVVPLDL-UHFFFAOYSA-N
InChI=1S/C14H20O2/c1-3-4-5-6-7-14(15)16-13-10-8-12(2)9-11-13/h8-11H,3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H20O2
Molecular Weight 220.3074
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 20:21:26 GMT 2023
Edited
by admin
on Sat Dec 16 20:21:26 GMT 2023
Record UNII
TN9E3F39DA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Methylphenyl heptanoate
Systematic Name English
p-Tolyl heptanoate
Systematic Name English
Heptanoic acid,4-methylphenyl ester
Systematic Name English
Code System Code Type Description
CAS
71662-19-6
Created by admin on Sat Dec 16 20:21:26 GMT 2023 , Edited by admin on Sat Dec 16 20:21:26 GMT 2023
PRIMARY
FDA UNII
TN9E3F39DA
Created by admin on Sat Dec 16 20:21:26 GMT 2023 , Edited by admin on Sat Dec 16 20:21:26 GMT 2023
PRIMARY