3-CHLORO-2-METHYL-1-PROPENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H7Cl
Molecular Weight	90.551
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-CHLORO-2-METHYL-1-PROPENE

Structure Search

SMILES

CC(=C)CCl

InChI

InChIKey=OHXAOPZTJOUYKM-UHFFFAOYSA-N

InChI=1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3

HIDE SMILES / InChI

Molecular Formula	C4H7Cl
Molecular Weight	90.551
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
Forestomach lesions in rats and mice administered 3-chloro-2-methylpropene by gavage for two years.	1986 Dec	3779651
Association of chemically induced forestomach cell proliferation and carcinogenesis.	1986 Sep	3768853
Comparative metabolism and disposition of 1-chloro- and 3-chloro-2-methylpropene in rats and mice.	1987 Jan-Feb	2881764
Chronic inhalation toxicity and carcinogenicity studies of 3-chloro-2-methylpropene in BDF1 mice.	2000 Jul	10943079
Point mutations of K-ras and H-ras genes in forestomach neoplasms from control B6C3F1 mice and following exposure to 1,3-butadiene, isoprene or chloroprene for up to 2-years.	2001 Jun 1	11397402
3-Chloro-2-methylpropene.	2002	15320322
3-Chloro-2-methylpropene.	2004	21089829
Cyclodextrins containing an acetone bridge. Synthesis and study as epoxidation catalysts.	2004 Dec 7	15565240
Highly regio- and chemoselective palladium-catalyzed propargylallylation of activated olefins: a novel route to 1,7-enyne derivatives.	2004 Jun 11	15176830
Experimental and theoretical studies on formation and degradation of chloro organic compounds.	2006 Mar	16146644
Dechlorination of beta-methylallyl chloride by electrogenerated [Co(I)(bipyridine)3]+: an electrochemical study in the presence of cationic surfactants.	2006 May 15	16376922
Quantitative structure-activity relationships for toxicity and genotoxicity of halogenated aliphatic compounds: wing spot test of Drosophila melanogaster.	2007 Feb	17113125
Application of the margin of exposure (MoE) approach to substances in food that are genotoxic and carcinogenic - example: 1-methylcyclopropene and its impurities (1-chloro-2-methylpropene and 3-chloro-2-methylpropene).	2010 Jan	19786060
Synthesis and effect on human HepG2 cells of 1,2-bis-(2-methylallyl)disulfane.	2010 May 18	20657504
8a-Methyl-5,6,8,8a,9,10-hexa-hydro-10,12a-epoxy-isoindolo[1,2-a]isoquinolinium iodide.	2010 May 19	21579469

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:57:20 GMT 2023` Edited by `admin` on `Fri Dec 15 18:57:20 GMT 2023`
Record UNII	7A9X1C3I3O
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-CHLORO-2-METHYL-1-PROPENE

Systematic Name

English

NCI-C54820

Code

English

.BETA.-METHYLALLYLCHLORIDE

Common Name

English

.BETA.-METHALLYL CHLORIDE

Common Name

English

3-CHLORO-2-METHYLPROP-1-ENE [HSDB]

Common Name

English

NSC-7303

Code

English

CHLORO-2-METHYLPROPENE, 3-

Systematic Name

English

.GAMMA.-CHLOROISOBUTYLENE

Common Name

English

3-CHLORO-2-METHYL-1-PROPENE [MI]

Common Name

English

METHALLYLCHLORIDE

Systematic Name

English

3-CHLORO-2-METHYLPROPENE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C45386