CHLOROACETOPHENONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H7ClO
Molecular Weight	154.594
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

ClCC(=O)C1=CC=CC=C1

InChI

InChIKey=IMACFCSSMIZSPP-UHFFFAOYSA-N

InChI=1S/C8H7ClO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6H2

HIDE SMILES / InChI

Molecular Formula	C8H7ClO
Molecular Weight	154.594
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
Transmammary modulation of xenobiotic metabolizing enzymes in liver of mouse pups by mace (Myristica fragrans Houtt.).	1994 May	7934086
Electron transfer compatible molecular design of benzothiophene-acetophenone bichromophores: a theoretical approach.	2001 Mar 1	11300566
Synthesis and hypnotic activities of 4-thio analogues of N3-substituted uridines.	2001 Sep	11558609
The use of chemical incapacitant sprays: a review.	2002 Mar	11901348
Tear gases and irritant incapacitants. 1-chloroacetophenone, 2-chlorobenzylidene malononitrile and dibenz[b,f]-1,4-oxazepine.	2003	15071820
[Saccharomyces cerevisiae B5 efficiently and stereoselectively reduces 2'-chloroacetophenone to R-2'-chloro-1-phenylethanol in the presence of 5% ethanol].	2003 Mar	15966323
Molecular structure and conformational composition of 2-chloro-1-phenylethanone, ClH2C-C(=O)Ph, obtained using gas-phase electron-diffraction data and results from theoretical calculations.	2005 Mar 10	16833522
Chlorobenzylidenemalonitrile gas exposure from a novelty personal-protection gun.	2007 May	20440402
An easy synthesis of 5-functionally substituted ethyl 4-amino-1-aryl- pyrazolo-3-carboxylates: interesting precursors to sildenafil analogues.	2007 May 1	17470302
Thermal decomposition studies of riot control agent ω-chloroacetophenone (CN) by pyrolysis-gas chromatography-mass spectrometry.	2010 Dec 15	20843603
Isolation of a Bacillus strain producing ketone reductase with high substrate tolerance.	2010 Feb	19767205

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:30:27 GMT 2023` Edited by `admin` on `Fri Dec 15 18:30:27 GMT 2023`
Record UNII	88B5039IQG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHLOROACETOPHENONE

Systematic Name

English

CHLOROACETOPHENONE, 2-

Systematic Name

English

2-CHLOROACETOPHENONE

Systematic Name

English

PHENYL CHLOROMETHYLKETONE

Systematic Name

English

OMEGA-CHLOROACETOPHENONE [HSDB]

Common Name

English

CHEMICAL MACE

Common Name

English

NSC-41666

Code

English

CHLOROACETOPHENONE [MART.]

Common Name

English

.OMEGA.-CHLOROACETOPHENONE [MI]

Common Name

English

CHLOROMETHYL PHENYL KETONE

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

18001