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155957-57-6 | Butane, 1,4-dibromo-1,1,2-trifluoro-
CAS No: 155957-57-6 Catalog No: AG001ODO MDL No:
Product Description
Catalog Number:
AG001ODO
Chemical Name:
Butane, 1,4-dibromo-1,1,2-trifluoro-
CAS Number:
155957-57-6
Molecular Formula:
C4H5Br2F3
Molecular Weight:
269.8857
IUPAC Name:
1,4-dibromo-1,1,2-trifluorobutane
InChI:
InChI=1S/C4H5Br2F3/c5-2-1-3(7)4(6,8)9/h3H,1-2H2
InChI Key:
UNPJUIZHZWFYLY-UHFFFAOYSA-N
SMILES:
BrCCC(C(Br)(F)F)F
Properties
Complexity:
85.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.869g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.887g/mol
Monoisotopic Mass:
267.871g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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