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140451-79-2 | Propane, 1-bromo-1,1,2-trifluoro-2-methyl-
CAS No: 140451-79-2 Catalog No: AG001CH4 MDL No:
Product Description
Catalog Number:
AG001CH4
Chemical Name:
Propane, 1-bromo-1,1,2-trifluoro-2-methyl-
CAS Number:
140451-79-2
Molecular Formula:
C4H6BrF3
Molecular Weight:
190.9896
IUPAC Name:
1-bromo-1,1,2-trifluoro-2-methylpropane
InChI:
InChI=1S/C4H6BrF3/c1-3(2,6)4(5,7)8/h1-2H3
InChI Key:
OMPBXUMQETUVQJ-UHFFFAOYSA-N
SMILES:
FC(C(F)(C)C)(Br)F
Properties
Complexity:
89.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.96g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.991g/mol
Monoisotopic Mass:
189.96g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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