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Details

Stereochemistry ACHIRAL
Molecular Formula C2HCl2N
Molecular Weight 109.942
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICHLOROACETONITRILE

SMILES

ClC(Cl)C#N

InChI

InChIKey=STZZWJCGRKXEFF-UHFFFAOYSA-N
InChI=1S/C2HCl2N/c3-2(4)1-5/h2H

HIDE SMILES / InChI

Molecular Formula C2HCl2N
Molecular Weight 109.942
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
The water disinfectant byproduct dibromoacetonitrile induces apoptosis in rat intestinal epithelial cells: possible role of redox imbalance.
2006
Dissolved organic nitrogen as a precursor for chloroform, dichloroacetonitrile, N-nitrosodimethylamine, and trichloronitromethane.
2007 Aug 1
Haloacetonitriles vs. regulated haloacetic acids: are nitrogen-containing DBPs more toxic?
2007 Jan 15
Reaction pathways of the diketonitrile degradate of isoxaflutole with hypochlorite in water.
2007 Mar 7
Childhood asthma and environmental exposures at swimming pools: state of the science and research recommendations.
2009 Apr
Volatile disinfection by-product analysis from chlorinated indoor swimming pools.
2009 Jul
Atom-transfer radical addition reactions catalyzed by RuCp* complexes: a mechanistic study.
2009 Nov 2
Formation of carbonaceous and nitrogenous disinfection by-products from the chlorination of Microcystis aeruginosa.
2010 Mar
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:41:43 GMT 2023
Edited
by admin
on Fri Dec 15 17:41:43 GMT 2023
Record UNII
O0L64V63M9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICHLOROACETONITRILE
HSDB  
Systematic Name English
DICHLOROMETHYL CYANIDE
Systematic Name English
DICHLOROACETONITRILE [HSDB]
Common Name English
ACETONITRILE, DICHLORO-
Systematic Name English
DICHLOROACETONITRILE [IARC]
Common Name English
NSC-60511
Code English
Code System Code Type Description
EPA CompTox
DTXSID3021562
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY
NSC
60511
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY
FDA UNII
O0L64V63M9
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY
ECHA (EC/EINECS)
221-159-4
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY
PUBCHEM
18177
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY
HSDB
6861
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY
CAS
3018-12-0
Created by admin on Fri Dec 15 17:41:43 GMT 2023 , Edited by admin on Fri Dec 15 17:41:43 GMT 2023
PRIMARY