1-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 1-CHLORO-2-METHYL-1-PROPENE

Structure Search

SMILES

CC(C)=CCl

InChI

InChIKey=KWISWUFGPUHDRY-UHFFFAOYSA-N

InChI=1S/C4H7Cl/c1-4(2)3-5/h3H,1-2H3

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
NTP Toxicology and Carcinogenesis Studies of Dimethylvinyl Chloride (1-Chloro-2-Methylpropene) (CAS No. 513-37-1) in F344/N Rats and B6C3F1 Mice (Gavage Studies).	1986 Aug	12748737
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
An update of the National Toxicology Program database on nasal carcinogens.	1997 Oct 31	9385384
Oral administration of dimethylvinyl chloride increases frequency of forestomach papillomas in Tg.AC mice.	2000 Dec	11170261
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
Dimethylvinyl chloride.	2002	15323052
Dimethylvinyl chloride.	2004	21089870
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
Dimethylvinyl chloride.	2011	21860474

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:05:49 GMT 2023` Edited by `admin` on `Fri Dec 15 17:05:49 GMT 2023`
Record UNII	JP8N4M44OP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-CHLORO-2-METHYL-1-PROPENE

Systematic Name

English

NCI-C54819

Code

English

.ALPHA.-CHLOROISOBUTYLENE

Common Name

English

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

Common Name

English

DIMETHYL VINYL CHLORIDE, 2,2-

Common Name

English

1-CHLORO-2-METHYL-1-PROPENE [HSDB]

Common Name

English

1-CHLORO-2-METHYLPROPENE

Systematic Name

English

2-METHYL-1-PROPENYL CHLORIDE

Systematic Name

English

2,2-DIMETHYLVINYL CHLORIDE

Systematic Name

English

1-CHLORO-2-METHYLPROPENE [IARC]

Common Name

English

.BETA.,.BETA.-DIMETHYLVINYL CHLORIDE

Common Name

English

ISOCROTYL CHLORIDE

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m3419