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Details

Stereochemistry ACHIRAL
Molecular Formula C5H9Cl
Molecular Weight 104.578
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-CHLORO-3-METHYL-2-BUTENE

SMILES

CC(C)=CCCl

InChI

InChIKey=JKXQKGNGJVZKFA-UHFFFAOYSA-N
InChI=1S/C5H9Cl/c1-5(2)3-4-6/h3H,4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H9Cl
Molecular Weight 104.578
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Synthesis of 5- and 6-carboxy-X-rhodamines.
2008-11-06
Volatile compounds in shoulder gland secretions of male flying foxes, genus Pteropus (Pteropodidae, Chiroptera).
2005-12-03
Solvation effects on alternative nucleophilic substitution reaction paths for chloride/allyl chloride and gamma-methylated congeners.
2003-08-08
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:23:53 GMT 2025
Edited
by admin
on Mon Mar 31 22:23:53 GMT 2025
Record UNII
KMT7V9LLBR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-CHLORO-3-METHYL-2-BUTENE
HSDB  
Systematic Name English
.GAMMA.,.GAMMA.-DIMETHYLALLYL CHLORIDE
Preferred Name English
2-METHYL-4-CHLORO-2-BUTENE
Systematic Name English
ISOPRENYL CHLORIDE
Systematic Name English
3-METHYLCROTYL CHLORIDE
Systematic Name English
2-BUTENE, 1-CHLORO-3-METHYL-
Systematic Name English
1-CHLORO-3-METHYLBUT-2-ENE
Systematic Name English
3,3-DIMETHYLALLYL CHLORIDE
Systematic Name English
1-CHLORO-3-METHYL-2-BUTENE [HSDB]
Common Name English
3-METHYL-2-BUTENYL CHLORIDE
Systematic Name English
3-METHYL-1-CHLORO-2-BUTENE
Systematic Name English
4-CHLORO-2-METHYL-2-BUTENE
Systematic Name English
PRENYL CHLORIDE
Systematic Name English
1,1-DIMETHYL-3-CHLORO-1-PROPENE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID7060120
Created by admin on Mon Mar 31 22:23:53 GMT 2025 , Edited by admin on Mon Mar 31 22:23:53 GMT 2025
PRIMARY
HSDB
6129
Created by admin on Mon Mar 31 22:23:53 GMT 2025 , Edited by admin on Mon Mar 31 22:23:53 GMT 2025
PRIMARY
CAS
503-60-6
Created by admin on Mon Mar 31 22:23:53 GMT 2025 , Edited by admin on Mon Mar 31 22:23:53 GMT 2025
PRIMARY
ECHA (EC/EINECS)
207-972-7
Created by admin on Mon Mar 31 22:23:53 GMT 2025 , Edited by admin on Mon Mar 31 22:23:53 GMT 2025
PRIMARY
PUBCHEM
10429
Created by admin on Mon Mar 31 22:23:53 GMT 2025 , Edited by admin on Mon Mar 31 22:23:53 GMT 2025
PRIMARY
FDA UNII
KMT7V9LLBR
Created by admin on Mon Mar 31 22:23:53 GMT 2025 , Edited by admin on Mon Mar 31 22:23:53 GMT 2025
PRIMARY