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Details

Stereochemistry MIXED
Molecular Formula C12H14O4
Molecular Weight 222.2372
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-METHYLBENZYLSUCCINIC ACID

SMILES

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

InChI

InChIKey=FDXVETHETURZLC-UHFFFAOYSA-N
InChI=1S/C12H14O4/c1-8(9-5-3-2-4-6-9)10(12(15)16)7-11(13)14/h2-6,8,10H,7H2,1H3,(H,13,14)(H,15,16)

HIDE SMILES / InChI

Molecular Formula C12H14O4
Molecular Weight 222.2372
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:10:40 GMT 2025
Edited
by admin
on Mon Mar 31 23:10:40 GMT 2025
Record UNII
2353RS6103
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYLBENZYLSUCCINIC ACID, .ALPHA.
Preferred Name English
.ALPHA.-METHYLBENZYLSUCCINIC ACID
Systematic Name English
SUCCINIC ACID, (.ALPHA.-METHYLBENZYL)-
Common Name English
BUTANEDIOIC ACID, 2-(1-PHENYLETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
2353RS6103
Created by admin on Mon Mar 31 23:10:40 GMT 2025 , Edited by admin on Mon Mar 31 23:10:40 GMT 2025
PRIMARY
PUBCHEM
2837676
Created by admin on Mon Mar 31 23:10:40 GMT 2025 , Edited by admin on Mon Mar 31 23:10:40 GMT 2025
PRIMARY
CAS
19263-14-0
Created by admin on Mon Mar 31 23:10:40 GMT 2025 , Edited by admin on Mon Mar 31 23:10:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID30385519
Created by admin on Mon Mar 31 23:10:40 GMT 2025 , Edited by admin on Mon Mar 31 23:10:40 GMT 2025
PRIMARY