sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 1-Chloro-3-methyl-2-butene

1-Chloro-3-methyl-2-butene

CAS No.:
503-60-6
Catalog Number:
AG0037RA
Molecular Formula:
C5H9Cl
Molecular Weight:
104.5780
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$63
- +
25g
95%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG0037RA
Chemical Name:
1-Chloro-3-methyl-2-butene
CAS Number:
503-60-6
Molecular Formula:
C5H9Cl
Molecular Weight:
104.5780
MDL Number:
MFCD00000982
IUPAC Name:
1-chloro-3-methylbut-2-ene
InChI:
InChI=1S/C5H9Cl/c1-5(2)3-4-6/h3H,4H2,1-2H3
InChI Key:
JKXQKGNGJVZKFA-UHFFFAOYSA-N
SMILES:
ClCC=C(C)C
EC Number:
207-972-7
UNII:
KMT7V9LLBR
Properties
Complexity:
51  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.039g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
104.577g/mol
Monoisotopic Mass:
104.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Synthesis of 5- and 6-carboxy-X-rhodamines. Organic letters 20081106
Volatile compounds in shoulder gland secretions of male flying foxes, genus Pteropus (Pteropodidae, Chiroptera). Zeitschrift fur Naturforschung. C, Journal of biosciences 20050101
Solvation effects on alternative nucleophilic substitution reaction paths for chloride/allyl chloride and gamma-methylated congeners. The Journal of organic chemistry 20030808
Properties