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

Details

Stereochemistry RACEMIC
Molecular Formula C10H11ClO2
Molecular Weight 198.646
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(Chloromethyl)-2-phenyl-1,3-dioxolane, cis-

SMILES

ClC[C@H]1CO[C@H](O1)C2=CC=CC=C2

InChI

InChIKey=NPLBOQRGKONXBX-VHSXEESVSA-N
InChI=1S/C10H11ClO2/c11-6-9-7-12-10(13-9)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2/t9-,10+/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H11ClO2
Molecular Weight 198.646
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:13:47 GMT 2025
Edited
by admin
on Wed Apr 02 19:13:47 GMT 2025
Record UNII
RSK8YWC2SB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(Chloromethyl)-2-phenyl-1,3-dioxolane, cis-
Systematic Name English
1,3-Dioxolane, 4-(chloromethyl)-2-phenyl-, (2R,4R)-rel-
Preferred Name English
4-(Chloromethyl)-2-phenyl-1,3-dioxolane, rel-(2R,4R)-
Systematic Name English
rel-(2R,4R)-4-(Chloromethyl)-2-phenyl-1,3-dioxolane
Systematic Name English
cis-4-(Chloromethyl)-2-phenyl-1,3-dioxolane
Systematic Name English
Code System Code Type Description
CAS
5932-71-8
Created by admin on Wed Apr 02 19:13:47 GMT 2025 , Edited by admin on Wed Apr 02 19:13:47 GMT 2025
PRIMARY
PUBCHEM
936352
Created by admin on Wed Apr 02 19:13:47 GMT 2025 , Edited by admin on Wed Apr 02 19:13:47 GMT 2025
PRIMARY
FDA UNII
RSK8YWC2SB
Created by admin on Wed Apr 02 19:13:47 GMT 2025 , Edited by admin on Wed Apr 02 19:13:47 GMT 2025
PRIMARY