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87375-46-0 | 2-Butanone, 1-chloro-1,1,3,3,4,4,4-heptafluoro-
CAS No: 87375-46-0 Catalog No: AG004GX3 MDL No:
Product Description
Catalog Number:
AG004GX3
Chemical Name:
2-Butanone, 1-chloro-1,1,3,3,4,4,4-heptafluoro-
CAS Number:
87375-46-0
Molecular Formula:
C4ClF7O
Molecular Weight:
232.4840
IUPAC Name:
1-chloro-1,1,3,3,4,4,4-heptafluorobutan-2-one
InChI:
InChI=1S/C4ClF7O/c5-3(8,9)1(13)2(6,7)4(10,11)12
InChI Key:
XCMXABCYOLFTAQ-UHFFFAOYSA-N
SMILES:
O=C(C(C(F)(F)F)(F)F)C(Cl)(F)F
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.953g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.482g/mol
Monoisotopic Mass:
231.953g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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