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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H10O4
Molecular Weight 194.184
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 5-ACETYLSALICYLATE

SMILES

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

InChI

InChIKey=XLSMGNNWSRNTIQ-UHFFFAOYSA-N
InChI=1S/C10H10O4/c1-6(11)7-3-4-9(12)8(5-7)10(13)14-2/h3-5,12H,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
METHYL 5-ACETYLSALICYLATE
Systematic Name English
METHYL 2-HYDROXY-5-ACETYLBENZOATE
Systematic Name English
5-ACETYL-2-HYDROXYBENZOIC ACID METHYL ESTER
Common Name English
BENZOIC ACID, 5-ACETYL-2-HYDROXY-, METHYL ESTER
Systematic Name English
METHYL 5-ACETYL-2-HYDROXYBENZOATE
Systematic Name English
NSC-67867
Code English
5-ACETYLSALICYLIC ACID METHYL ESTER
Common Name English
SALICYLIC ACID, 5-ACETYL-, METHYL ESTER
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80167807
Created by admin on Sat Dec 16 19:00:42 GMT 2023 , Edited by admin on Sat Dec 16 19:00:42 GMT 2023
PRIMARY
CAS
16475-90-4
Created by admin on Sat Dec 16 19:00:42 GMT 2023 , Edited by admin on Sat Dec 16 19:00:42 GMT 2023
PRIMARY
NSC
67867
Created by admin on Sat Dec 16 19:00:42 GMT 2023 , Edited by admin on Sat Dec 16 19:00:42 GMT 2023
PRIMARY
FDA UNII
5LXG3K3H5F
Created by admin on Sat Dec 16 19:00:42 GMT 2023 , Edited by admin on Sat Dec 16 19:00:42 GMT 2023
PRIMARY
PUBCHEM
85444
Created by admin on Sat Dec 16 19:00:42 GMT 2023 , Edited by admin on Sat Dec 16 19:00:42 GMT 2023
PRIMARY
ECHA (EC/EINECS)
240-532-2
Created by admin on Sat Dec 16 19:00:42 GMT 2023 , Edited by admin on Sat Dec 16 19:00:42 GMT 2023
PRIMARY