Home Halogens Pentane, 2-bromo-4-methyl-

Pentane, 2-bromo-4-methyl-

CAS No.:
30310-22-6
Catalog Number:
AG002ZME
Molecular Formula:
C6H13Br
Molecular Weight:
165.0714
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Product Description
Catalog Number:
AG002ZME
Chemical Name:
Pentane, 2-bromo-4-methyl-
CAS Number:
30310-22-6
Molecular Formula:
C6H13Br
Molecular Weight:
165.0714
MDL Number:
MFCD00043446
IUPAC Name:
2-bromo-4-methylpentane
InChI:
InChI=1S/C6H13Br/c1-5(2)4-6(3)7/h5-6H,4H2,1-3H3
InChI Key:
IUXIOXCOPJFKMQ-UHFFFAOYSA-N
SMILES:
CC(CC(Br)C)C
EC Number:
250-123-0
Properties
Complexity:
41.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.02g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.074g/mol
Monoisotopic Mass:
164.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties