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25346-31-0 | 3-Bromo-3-methylpentane
CAS No: 25346-31-0 Catalog No: AG0037RH MDL No:MFCD00013533
Product Description
Catalog Number:
AG0037RH
Chemical Name:
3-Bromo-3-methylpentane
CAS Number:
25346-31-0
Molecular Formula:
C6H13Br
Molecular Weight:
165.0714
MDL Number:
MFCD00013533
IUPAC Name:
3-bromo-3-methylpentane
InChI:
InChI=1S/C6H13Br/c1-4-6(3,7)5-2/h4-5H2,1-3H3
InChI Key:
ZRPQYKLJSOLRPZ-UHFFFAOYSA-N
SMILES:
CCC(CC)(Br)C
EC Number:
246-878-0
Properties
Complexity:
46.1
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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