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

Details

Stereochemistry MIXED
Molecular Formula C10H14Cl2O3S
Molecular Weight 285.187
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-[(2-Chloroethyl)sulfonyl]bicyclo[2.2.1]heptane-2-carbonyl chloride

SMILES

ClCCS(=O)(=O)C1C[C@@H]2C[C@H]1CC2C(Cl)=O

InChI

InChIKey=LCOLLZNVOZERDL-MSIFESELSA-N
InChI=1S/C10H14Cl2O3S/c11-1-2-16(14,15)9-5-6-3-7(9)4-8(6)10(12)13/h6-9H,1-5H2/t6-,7-,8?,9?/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H14Cl2O3S
Molecular Weight 285.187
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 2 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 08:56:08 GMT 2025
Edited
by admin
on Wed Apr 02 08:56:08 GMT 2025
Record UNII
8A436VR7F3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-[(2-Chloroethyl)sulphonyl]bicyclo[2.2.1]heptane-2-carbonyl chloride
Preferred Name English
5-[(2-Chloroethyl)sulfonyl]bicyclo[2.2.1]heptane-2-carbonyl chloride
Systematic Name English
Bicyclo[2.2.1]heptane-2-carbonyl chloride, 5-[(2-chloroethyl)sulfonyl]-
Systematic Name English
Bicyclo[2.2.1]heptane-2-carbonyl chloride, 5-[(2-chloroethyl)sulphonyl]-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00944511
Created by admin on Wed Apr 02 08:56:08 GMT 2025 , Edited by admin on Wed Apr 02 08:56:08 GMT 2025
PRIMARY
CAS
21912-24-3
Created by admin on Wed Apr 02 08:56:08 GMT 2025 , Edited by admin on Wed Apr 02 08:56:08 GMT 2025
PRIMARY
PUBCHEM
89548
Created by admin on Wed Apr 02 08:56:08 GMT 2025 , Edited by admin on Wed Apr 02 08:56:08 GMT 2025
PRIMARY
FDA UNII
8A436VR7F3
Created by admin on Wed Apr 02 08:56:08 GMT 2025 , Edited by admin on Wed Apr 02 08:56:08 GMT 2025
PRIMARY