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87375-48-2 | 2-Butanone, 1,1-dichloro-1,3,3,4,4,4-hexafluoro-
CAS No: 87375-48-2 Catalog No: AG004K7D MDL No:
Product Description
Catalog Number:
AG004K7D
Chemical Name:
2-Butanone, 1,1-dichloro-1,3,3,4,4,4-hexafluoro-
CAS Number:
87375-48-2
Molecular Formula:
C4Cl2F6O
Molecular Weight:
248.9386
IUPAC Name:
1,1-dichloro-1,3,3,4,4,4-hexafluorobutan-2-one
InChI:
InChI=1S/C4Cl2F6O/c5-3(6,9)1(13)2(7,8)4(10,11)12
InChI Key:
CROPNACMOMFDMX-UHFFFAOYSA-N
SMILES:
O=C(C(C(F)(F)F)(F)F)C(Cl)(Cl)F
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.923g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.933g/mol
Monoisotopic Mass:
247.923g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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