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Details

Stereochemistry ACHIRAL
Molecular Formula C2H2IN
Molecular Weight 166.9485
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Iodoacetonitrile

SMILES

ICC#N

InChI

InChIKey=VODKOOOHHCAWFR-UHFFFAOYSA-N
InChI=1S/C2H2IN/c3-1-2-4/h1H2

HIDE SMILES / InChI

Molecular Formula C2H2IN
Molecular Weight 166.9485
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 18:38:10 GMT 2025
Edited
by admin
on Tue Apr 01 18:38:10 GMT 2025
Record UNII
EXK5ZB5CF6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Iodoacetonitrile
Systematic Name English
Acetonitrile, iodo-
Preferred Name English
Cyanoiodomethane
Systematic Name English
Cyanomethyl iodide
Systematic Name English
NSC-81208
Code English
Code System Code Type Description
ECHA (EC/EINECS)
210-860-0
Created by admin on Tue Apr 01 18:38:10 GMT 2025 , Edited by admin on Tue Apr 01 18:38:10 GMT 2025
PRIMARY
NSC
81208
Created by admin on Tue Apr 01 18:38:10 GMT 2025 , Edited by admin on Tue Apr 01 18:38:10 GMT 2025
PRIMARY
PUBCHEM
69356
Created by admin on Tue Apr 01 18:38:10 GMT 2025 , Edited by admin on Tue Apr 01 18:38:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID8073215
Created by admin on Tue Apr 01 18:38:10 GMT 2025 , Edited by admin on Tue Apr 01 18:38:10 GMT 2025
PRIMARY
FDA UNII
EXK5ZB5CF6
Created by admin on Tue Apr 01 18:38:10 GMT 2025 , Edited by admin on Tue Apr 01 18:38:10 GMT 2025
PRIMARY
CAS
624-75-9
Created by admin on Tue Apr 01 18:38:10 GMT 2025 , Edited by admin on Tue Apr 01 18:38:10 GMT 2025
PRIMARY