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

Details

Stereochemistry ACHIRAL
Molecular Formula C3H4ClNS
Molecular Weight 121.589
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Chloroethyl thiocyanate

SMILES

ClCCSC#N

InChI

InChIKey=DYLSBDPBASJBDZ-UHFFFAOYSA-N
InChI=1S/C3H4ClNS/c4-1-2-6-3-5/h1-2H2

HIDE SMILES / InChI

Molecular Formula C3H4ClNS
Molecular Weight 121.589
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 Tue Apr 01 19:05:38 GMT 2025
Edited
by admin
on Tue Apr 01 19:05:38 GMT 2025
Record UNII
T2X64P2YJA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Chloroethyl thiocyanate
Systematic Name English
NSC-196140
Preferred Name English
TL-335
Code English
Thiocyanic acid, 2-chloroethyl ester
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
213-177-6
Created by admin on Tue Apr 01 19:05:38 GMT 2025 , Edited by admin on Tue Apr 01 19:05:38 GMT 2025
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FDA UNII
T2X64P2YJA
Created by admin on Tue Apr 01 19:05:38 GMT 2025 , Edited by admin on Tue Apr 01 19:05:38 GMT 2025
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PUBCHEM
70231
Created by admin on Tue Apr 01 19:05:38 GMT 2025 , Edited by admin on Tue Apr 01 19:05:38 GMT 2025
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CAS
928-57-4
Created by admin on Tue Apr 01 19:05:38 GMT 2025 , Edited by admin on Tue Apr 01 19:05:38 GMT 2025
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EPA CompTox
DTXSID90239145
Created by admin on Tue Apr 01 19:05:38 GMT 2025 , Edited by admin on Tue Apr 01 19:05:38 GMT 2025
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NSC
196140
Created by admin on Tue Apr 01 19:05:38 GMT 2025 , Edited by admin on Tue Apr 01 19:05:38 GMT 2025
PRIMARY