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Home > Fluorides > 113487-28-8
113487-28-8 | 3-Nonanone, 1,1,1,2-tetrafluoro-
CAS No: 113487-28-8 Catalog No: AG0008R1 MDL No:
Product Description
Catalog Number:
AG0008R1
Chemical Name:
3-Nonanone, 1,1,1,2-tetrafluoro-
CAS Number:
113487-28-8
Molecular Formula:
C9H14F4O
Molecular Weight:
214.2005
IUPAC Name:
1,1,1,2-tetrafluorononan-3-one
InChI:
InChI=1S/C9H14F4O/c1-2-3-4-5-6-7(14)8(10)9(11,12)13/h8H,2-6H2,1H3
InChI Key:
XUJYARZOYKZDCD-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)C(C(F)(F)F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.204g/mol
Monoisotopic Mass:
214.098g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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