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Home Other Building Blocks 1-BROMO-2,2-DIMETHYLPROPANE

1-BROMO-2,2-DIMETHYLPROPANE

CAS No.:
630-17-1
Catalog Number:
AG003E2O
Molecular Formula:
C5H11Br
Molecular Weight:
151.0448
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Product Description
Catalog Number:
AG003E2O
Chemical Name:
1-BROMO-2,2-DIMETHYLPROPANE
CAS Number:
630-17-1
Molecular Formula:
C5H11Br
Molecular Weight:
151.0448
MDL Number:
MFCD00000209
IUPAC Name:
1-bromo-2,2-dimethylpropane
InChI:
InChI=1S/C5H11Br/c1-5(2,3)4-6/h4H2,1-3H3
InChI Key:
CQWYAXCOVZKLHY-UHFFFAOYSA-N
SMILES:
BrCC(C)(C)C
EC Number:
211-132-5
Properties
Complexity:
33.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.004g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.047g/mol
Monoisotopic Mass:
150.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Replacing conventional carbon nucleophiles with electrophiles: nickel-catalyzed reductive alkylation of aryl bromides and chlorides. Journal of the American Chemical Society 20120411
Isomerization of neopentyl chloride and neopentyl bromide by a 1,2-interchange of a halogen atom and a methyl group. The journal of physical chemistry. A 20100930
Properties