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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H13ClO2
Molecular Weight 248.705
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-CHLOROPHENYL)-1-PHENYL-1,2-ETHANDIOL, (S)-

SMILES

OC[C@](O)(C1=CC=CC=C1)C2=CC=C(Cl)C=C2

InChI

InChIKey=FIPSQBMKYNRHDF-AWEZNQCLSA-N
InChI=1S/C14H13ClO2/c15-13-8-6-12(7-9-13)14(17,10-16)11-4-2-1-3-5-11/h1-9,16-17H,10H2/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H13ClO2
Molecular Weight 248.705
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 Mon Mar 31 23:41:56 GMT 2025
Edited
by admin
on Mon Mar 31 23:41:56 GMT 2025
Record UNII
H8XVK9X6V8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-CHLOROPHENYL)-1-PHENYL-1,2-ETHANDIOL, (S)-
Systematic Name English
CLEMASTINE (M6), (S)-
Preferred Name English
1,2-ETHANEDIOL, 1-(4-CHLOROPHENYL)-1-PHENYL-, (1S)-
Systematic Name English
Code System Code Type Description
FDA UNII
H8XVK9X6V8
Created by admin on Mon Mar 31 23:41:56 GMT 2025 , Edited by admin on Mon Mar 31 23:41:56 GMT 2025
PRIMARY
CAS
1342906-28-8
Created by admin on Mon Mar 31 23:41:56 GMT 2025 , Edited by admin on Mon Mar 31 23:41:56 GMT 2025
PRIMARY
PUBCHEM
90478870
Created by admin on Mon Mar 31 23:41:56 GMT 2025 , Edited by admin on Mon Mar 31 23:41:56 GMT 2025
PRIMARY