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30263-65-1 | 2-Butanone, 1,1-dibromo-3,3-dimethyl-
CAS No: 30263-65-1 Catalog No: AG002ZF1 MDL No:MFCD00045030
Product Description
Catalog Number:
AG002ZF1
Chemical Name:
2-Butanone, 1,1-dibromo-3,3-dimethyl-
CAS Number:
30263-65-1
Molecular Formula:
C6H10Br2O
Molecular Weight:
257.9510
MDL Number:
MFCD00045030
IUPAC Name:
1,1-dibromo-3,3-dimethylbutan-2-one
InChI:
InChI=1S/C6H10Br2O/c1-6(2,3)4(9)5(7)8/h5H,1-3H3
InChI Key:
WIPDATICDHNWKG-UHFFFAOYSA-N
SMILES:
BrC(C(=O)C(C)(C)C)Br
NSC Number:
195963
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.908g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.953g/mol
Monoisotopic Mass:
255.91g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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