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26356-06-9 | Butane, 3-bromo-2,2-dimethyl-
CAS No: 26356-06-9 Catalog No: AG002SV9 MDL No:
Product Description
Catalog Number:
AG002SV9
Chemical Name:
Butane, 3-bromo-2,2-dimethyl-
CAS Number:
26356-06-9
Molecular Formula:
C6H13Br
Molecular Weight:
165.0714
IUPAC Name:
3-bromo-2,2-dimethylbutane
InChI:
InChI=1S/C6H13Br/c1-5(7)6(2,3)4/h5H,1-4H3
InChI Key:
DGTGXWOFOTZORM-UHFFFAOYSA-N
SMILES:
CC(C(C)(C)C)Br
Properties
Complexity:
51.7
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:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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