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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H10Cl2OS
Molecular Weight 285.189
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-CHLOROBENZYL-P-CHLOROPHENYL SULFOXIDE, (S)-

SMILES

[O-][S@@+](CC1=CC=C(Cl)C=C1)C2=CC=C(Cl)C=C2

InChI

InChIKey=HWBAOLWSMWCAPA-KRWDZBQOSA-N
InChI=1S/C13H10Cl2OS/c14-11-3-1-10(2-4-11)9-17(16)13-7-5-12(15)6-8-13/h1-8H,9H2/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H10Cl2OS
Molecular Weight 285.189
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:42:14 GMT 2025
Edited
by admin
on Mon Mar 31 21:42:14 GMT 2025
Record UNII
7JR77LFR8U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-CHLOROBENZYL-P-CHLOROPHENYL SULFOXIDE, (S)-
Common Name English
BENZENE, 1-CHLORO-4-((S)-((4-CHLOROPHENYL)METHYL)SULFINYL)-
Preferred Name English
1-CHLORO-4-((S)-((4-CHLOROPHENYL)METHYL)SULFINYL)BENZENE
Common Name English
Code System Code Type Description
FDA UNII
7JR77LFR8U
Created by admin on Mon Mar 31 21:42:14 GMT 2025 , Edited by admin on Mon Mar 31 21:42:14 GMT 2025
PRIMARY
CAS
1478863-84-1
Created by admin on Mon Mar 31 21:42:14 GMT 2025 , Edited by admin on Mon Mar 31 21:42:14 GMT 2025
PRIMARY
PUBCHEM
92258447
Created by admin on Mon Mar 31 21:42:14 GMT 2025 , Edited by admin on Mon Mar 31 21:42:14 GMT 2025
PRIMARY PUBCHEM
Related Record Type Details
RACEMATE -> ENANTIOMER
ENANTIOMER -> ENANTIOMER