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

Details

Stereochemistry RACEMIC
Molecular Formula C9H10O3
Molecular Weight 166.1739
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHOXYPHENYLACETIC ACID

SMILES

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

InChI

InChIKey=DIWVBIXQCNRCFE-UHFFFAOYSA-N
InChI=1S/C9H10O3/c1-12-8(9(10)11)7-5-3-2-4-6-7/h2-6,8H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C9H10O3
Molecular Weight 166.1739
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:00:41 GMT 2023
Edited
by admin
on Sat Dec 16 08:00:41 GMT 2023
Record UNII
MAT0P17A95
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHOXYPHENYLACETIC ACID
Systematic Name English
(RS)-2-METHOXY-2-PHENYLACETIC ACID
Systematic Name English
(±)-2-METHOXY-2-PHENYLACETIC ACID
Systematic Name English
2-METHOXY-2-PHENYLACETIC ACID
Systematic Name English
BENZENEACETIC ACID, .ALPHA.-METHOXY-
Systematic Name English
(±)-.ALPHA.-METHOXYPHENYLACETIC ACID
Systematic Name English
DL-METHOXYPHENYLACETIC ACID
Systematic Name English
NSC-5665
Code English
MOPA
Common Name English
METHOXYPHENYLACETIC ACID, (±)-
Systematic Name English
Code System Code Type Description
CAS
1701-77-5
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
SUPERSEDED
FDA UNII
MAT0P17A95
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
PRIMARY
PUBCHEM
107202
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
PRIMARY
ECHA (EC/EINECS)
230-300-9
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID9020829
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
PRIMARY
ECHA (EC/EINECS)
216-933-3
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
ALTERNATIVE
CAS
7021-09-2
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
PRIMARY
NSC
5665
Created by admin on Sat Dec 16 08:00:41 GMT 2023 , Edited by admin on Sat Dec 16 08:00:41 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE