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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

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

Unknown
149124
PubMed

PubMed

TitleDatePubMed
8a-Methyl-5,6,8,8a,9,10-hexa-hydro-10,12a-epoxy-isoindolo[1,2-a]isoquinolinium iodide.
2010-05-19
Synthesis and effect on human HepG2 cells of 1,2-bis-(2-methylallyl)disulfane.
2010-05-18
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).
2010-01
Quantitative structure-activity relationships for toxicity and genotoxicity of halogenated aliphatic compounds: wing spot test of Drosophila melanogaster.
2007-02
Dechlorination of beta-methylallyl chloride by electrogenerated [Co(I)(bipyridine)3]+: an electrochemical study in the presence of cationic surfactants.
2006-05-15
Experimental and theoretical studies on formation and degradation of chloro organic compounds.
2006-03
Cyclodextrins containing an acetone bridge. Synthesis and study as epoxidation catalysts.
2004-12-07
Highly regio- and chemoselective palladium-catalyzed propargylallylation of activated olefins: a novel route to 1,7-enyne derivatives.
2004-06-11
3-Chloro-2-methylpropene.
2004
3-Chloro-2-methylpropene.
2002
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.
2001-06-01
Chronic inhalation toxicity and carcinogenicity studies of 3-chloro-2-methylpropene in BDF1 mice.
2000-07
Comparative metabolism and disposition of 1-chloro- and 3-chloro-2-methylpropene in rats and mice.
1987-01-01
Forestomach lesions in rats and mice administered 3-chloro-2-methylpropene by gavage for two years.
1986-12
Association of chemically induced forestomach cell proliferation and carcinogenesis.
1986-09
Patents

Patents

04032649
3
04123393
1
04148826
1
04352748
1
04446151
6
04895871
1
04967033
1
05039691
1
05180741
1
05304563
2
05576448
1
05607898
1
05616718
4
05739134
1
06083987
1
06403639
2
06632826
2
07074793
1
07314888
29
07482417
1
07579469
2
07935819
6
08410293
1
08598374
1
08680093
3
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:27:51 GMT 2025
Edited
by admin
on Mon Mar 31 19:27:51 GMT 2025
Record UNII
7A9X1C3I3O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NCI-C54820
Preferred Name English
3-CHLORO-2-METHYL-1-PROPENE
MI  
Systematic Name 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
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
Code System Code Type Description
NSC
7303
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
NCI_THESAURUS
C44317
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
SMS_ID
300000052954
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID1020279
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-251-2
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
FDA UNII
7A9X1C3I3O
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
MERCK INDEX
m3420
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY Merck Index
HSDB
1149
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
WIKIPEDIA
Methallyl chloride
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
PUBCHEM
11241
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
CAS
563-47-3
Created by admin on Mon Mar 31 19:27:51 GMT 2025 , Edited by admin on Mon Mar 31 19:27:51 GMT 2025
PRIMARY
NIH
NCATS
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