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116530-77-9 | Hexane, 2,2-dibromo-
CAS No: 116530-77-9 Catalog No: AG000CQH MDL No:MFCD09908238
Product Description
Catalog Number:
AG000CQH
Chemical Name:
Hexane, 2,2-dibromo-
CAS Number:
116530-77-9
Molecular Formula:
C6H12Br2
Molecular Weight:
243.9675
MDL Number:
MFCD09908238
IUPAC Name:
2,2-dibromohexane
InChI:
InChI=1S/C6H12Br2/c1-3-4-5-6(2,7)8/h3-5H2,1-2H3
InChI Key:
WSKZKJCPOXIQTN-UHFFFAOYSA-N
SMILES:
CCCCC(Br)(Br)C
Properties
Complexity:
59.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.929g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.97g/mol
Monoisotopic Mass:
241.931g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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