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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O5S
Molecular Weight 244.264
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 5-MESYL-O-ANISATE

SMILES

COC(=O)C1=CC(=CC=C1OC)S(C)(=O)=O

InChI

InChIKey=DSRPTFIZJVCPPS-UHFFFAOYSA-N
InChI=1S/C10H12O5S/c1-14-9-5-4-7(16(3,12)13)6-8(9)10(11)15-2/h4-6H,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H12O5S
Molecular Weight 244.264
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Thu Jul 06 18:01:43 UTC 2023
Edited
by admin
on Thu Jul 06 18:01:43 UTC 2023
Record UNII
O86O9BO8DJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 5-MESYL-O-ANISATE
Common Name English
BENZOIC ACID, 2-METHOXY-5-(METHYLSULFONYL)-, METHYL ESTER
Systematic Name English
METHYL 2-METHOXY-5-(METHYLSULFONYL)BENZOATE
Systematic Name English
TIAPRIDE HYDROCHLORIDE IMPURITY A [EP IMPURITY]
Common Name English
Code System Code Type Description
CAS
63484-12-8
Created by admin on Thu Jul 06 18:01:43 UTC 2023 , Edited by admin on Thu Jul 06 18:01:43 UTC 2023
PRIMARY
EPA CompTox
DTXSID30212891
Created by admin on Thu Jul 06 18:01:43 UTC 2023 , Edited by admin on Thu Jul 06 18:01:43 UTC 2023
PRIMARY
ECHA (EC/EINECS)
264-267-7
Created by admin on Thu Jul 06 18:01:43 UTC 2023 , Edited by admin on Thu Jul 06 18:01:43 UTC 2023
PRIMARY
PUBCHEM
6454622
Created by admin on Thu Jul 06 18:01:43 UTC 2023 , Edited by admin on Thu Jul 06 18:01:43 UTC 2023
PRIMARY
FDA UNII
O86O9BO8DJ
Created by admin on Thu Jul 06 18:01:43 UTC 2023 , Edited by admin on Thu Jul 06 18:01:43 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP