TRICHLOROACETONITRILE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C2Cl3N
Molecular Weight	144.387
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

ClC(Cl)(Cl)C#N

InChI

InChIKey=DRUIESSIVFYOMK-UHFFFAOYSA-N

InChI=1S/C2Cl3N/c3-2(4,5)1-6

HIDE SMILES / InChI

Molecular Formula	C2Cl3N
Molecular Weight	144.387
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Expanding stereochemical and skeletal diversity using petasis reactions and 1,3-dipolar cycloadditions.	2010-11-19	20977261
Catalytic asymmetric synthesis of chiral allylic esters.	2010-11-03	20942420
Production of various disinfection byproducts in indoor swimming pool waters treated with different disinfection methods.	2010-11	20961810
First principles insight into the alpha-glucan structures of starch: their synthesis, conformation, and hydration.	2010-04-14	20302376
Rearrangement strategy for the synthesis of 2-aminoanilines.	2010-04-02	20199033
Chlorination disinfection by-products in drinking water and congenital anomalies: review and meta-analyses.	2009-10	20019896
(Z)-2,2,2-Trichloro-N-cyano-acetamidine.	2009-08-12	21577545
Characterization of dissolved organic matter fractions and its relationship with the disinfection by-product formation.	2009	19402400
Synthesis of 5-substituted 3-amino-1H-pyrazole-4-carbonitriles as precursors for microwave assisted regiospecific syntheses of pyrazolo[1,5-a]pyrimidines.	2008-12-29	19127239
Regio- and stereoselective anomeric esterification of glucopyranose 1,2-diols and a facile preparation of 2-O-acetylated glucopyranosyl trichloroacetimidates from the corresponding 1,2-diols.	2007-05-07	17300768
Effects of dissolved oxygen and iron aging on the reduction of trichloronitromethane, trichloracetonitrile, and trichloropropanone.	2007-02	17095038
Haloacetonitriles vs. regulated haloacetic acids: are nitrogen-containing DBPs more toxic?	2007-01-15	17310735
Experimental and theoretical investigation of the Raman and hyper-Raman spectra of acetonitrile and its derivatives.	2006-06-28	16821982
[NMR study on the determination of structure in the protected glucosamineoside].	2004-11	15762510
Linear free-energy relationship analysis of the fate of chlorinated 1- and 2-carbon compounds by redox-manipulated smectite clay minerals.	2003-10	14551992
Large-scale preparation of the phytoalexin elicitor glucohexatose and its application as a green pesticide.	2003-02-12	12568560
Synthesis of alpha-lactosyl-(1-->3)-L-glycero-alpha-D-manno-heptopyranoside, a partial oligosaccharide structure expressed within the lipooligosaccharide produced by Neisseria gonorrhoeae strain 15253.	2002-01-07	11755907
Transformation of chlorinated aliphatic compounds by ferruginous smectite.	2001-02-15	11349296

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:11:52 GMT 2025` Edited by `admin` on `Mon Mar 31 19:11:52 GMT 2025`
Record UNII	6397DL8869
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TRITOX

Preferred Name

English

TRICHLOROACETONITRILE

Systematic Name

English

TRICHLOROACETONITRILE [HSDB]

Common Name

English

TRICHLOROACETONITRILE [MI]

Common Name

English

2,2,2-TRICHLOROACETONITRILE

Systematic Name

English

CYANOTRICHLOROMETHANE

Systematic Name

English

NSC-66405

Code

English

TRICHLOROACETONITRILE [IARC]

Common Name

English

Code System Code Type Description

HSDB

7618