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
Transformation of chlorinated aliphatic compounds by ferruginous smectite.	2001 Feb 15	11349296
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 Jan 7	11755907
Large-scale preparation of the phytoalexin elicitor glucohexatose and its application as a green pesticide.	2003 Feb 12	12568560
Linear free-energy relationship analysis of the fate of chlorinated 1- and 2-carbon compounds by redox-manipulated smectite clay minerals.	2003 Oct	14551992
[NMR study on the determination of structure in the protected glucosamineoside].	2004 Nov	15762510
Experimental and theoretical investigation of the Raman and hyper-Raman spectra of acetonitrile and its derivatives.	2006 Jun 28	16821982
Effects of dissolved oxygen and iron aging on the reduction of trichloronitromethane, trichloracetonitrile, and trichloropropanone.	2007 Feb	17095038
Haloacetonitriles vs. regulated haloacetic acids: are nitrogen-containing DBPs more toxic?	2007 Jan 15	17310735
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 May 7	17300768
Synthesis of 5-substituted 3-amino-1H-pyrazole-4-carbonitriles as precursors for microwave assisted regiospecific syntheses of pyrazolo[1,5-a]pyrimidines.	2008 Dec 29	19127239
Characterization of dissolved organic matter fractions and its relationship with the disinfection by-product formation.	2009	19402400
(Z)-2,2,2-Trichloro-N-cyano-acetamidine.	2009 Aug 12	21577545
Chlorination disinfection by-products in drinking water and congenital anomalies: review and meta-analyses.	2009 Oct	20019896
First principles insight into the alpha-glucan structures of starch: their synthesis, conformation, and hydration.	2010 Apr 14	20302376
Rearrangement strategy for the synthesis of 2-aminoanilines.	2010 Apr 2	20199033
Production of various disinfection byproducts in indoor swimming pool waters treated with different disinfection methods.	2010 Nov	20961810
Expanding stereochemical and skeletal diversity using petasis reactions and 1,3-dipolar cycloadditions.	2010 Nov 19	20977261
Catalytic asymmetric synthesis of chiral allylic esters.	2010 Nov 3	20942420

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:22:57 GMT 2023` Edited by `admin` on `Fri Dec 15 18:22:57 GMT 2023`
Record UNII	6397DL8869
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

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

TRITOX

Brand Name

English

NSC-66405

Code

English

TRICHLOROACETONITRILE [IARC]

Common Name

English

Code System Code Type Description

HSDB

7618