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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10O3
Molecular Weight 166.1739
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(1-HYDROXYETHYL)BENZOIC ACID, (S)-

SMILES

C[C@H](O)C1=CC=C(C=C1)C(O)=O

InChI

InChIKey=UBXQIJLWYJGCCO-LURJTMIESA-N
InChI=1S/C9H10O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-6,10H,1H3,(H,11,12)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H10O3
Molecular Weight 166.1739
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:24:30 GMT 2025
Edited
by admin
on Tue Apr 01 16:24:30 GMT 2025
Record UNII
XC9PIV4KCK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(1-HYDROXYETHYL)BENZOIC ACID, (S)-
Common Name English
4-(1-HYDROXYETHYL)BENZOIC ACID, (-)-
Preferred Name English
BENZOIC ACID, 4-(1-HYDROXYETHYL)-, (S)-
Systematic Name English
BENZOIC ACID, 4-((1S)-1-HYDROXYETHYL)-
Systematic Name English
Code System Code Type Description
CAS
125577-89-1
Created by admin on Tue Apr 01 16:24:30 GMT 2025 , Edited by admin on Tue Apr 01 16:24:30 GMT 2025
PRIMARY
FDA UNII
XC9PIV4KCK
Created by admin on Tue Apr 01 16:24:30 GMT 2025 , Edited by admin on Tue Apr 01 16:24:30 GMT 2025
PRIMARY
PUBCHEM
40461207
Created by admin on Tue Apr 01 16:24:30 GMT 2025 , Edited by admin on Tue Apr 01 16:24:30 GMT 2025
PRIMARY