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Details

Stereochemistry ACHIRAL
Molecular Formula C10H10O3
Molecular Weight 178.1846
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 3-(2-oxoethyl)benzoate

SMILES

COC(=O)C1=CC(CC=O)=CC=C1

InChI

InChIKey=ZECXBDQLXINILP-UHFFFAOYSA-N
InChI=1S/C10H10O3/c1-13-10(12)9-4-2-3-8(7-9)5-6-11/h2-4,6-7H,5H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Methyl 3-(2-oxoethyl)benzoate
Systematic Name English
3-(2-Oxoethyl)benzoic acid methyl ester
Systematic Name English
Benzoic acid, 3-(2-oxoethyl)-, methyl ester
Systematic Name English
Code System Code Type Description
CAS
124038-37-5
Created by admin on Sat Dec 16 20:02:21 GMT 2023 , Edited by admin on Sat Dec 16 20:02:21 GMT 2023
PRIMARY
FDA UNII
EHE2YP5238
Created by admin on Sat Dec 16 20:02:21 GMT 2023 , Edited by admin on Sat Dec 16 20:02:21 GMT 2023
PRIMARY
PUBCHEM
19688564
Created by admin on Sat Dec 16 20:02:21 GMT 2023 , Edited by admin on Sat Dec 16 20:02:21 GMT 2023
PRIMARY
NIH
NCATS
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