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119450-75-8 | Butane, 1,2,2,3,4-pentafluoro-
CAS No: 119450-75-8 Catalog No: AG000ISJ MDL No:
Product Description
Catalog Number:
AG000ISJ
Chemical Name:
Butane, 1,2,2,3,4-pentafluoro-
CAS Number:
119450-75-8
Molecular Formula:
C4H5F5
Molecular Weight:
148.0745
IUPAC Name:
1,2,2,3,4-pentafluorobutane
InChI:
InChI=1S/C4H5F5/c5-1-3(7)4(8,9)2-6/h3H,1-2H2
InChI Key:
IOTWXMNNAJMNKW-UHFFFAOYSA-N
SMILES:
FCC(C(CF)(F)F)F
Properties
Complexity:
81
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.031g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.076g/mol
Monoisotopic Mass:
148.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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