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89176-03-4 | 4-Undecen-3-one, 1,1,1,2,2-pentafluoro-, (E)-
CAS No: 89176-03-4 Catalog No: AG003WA4 MDL No:
Product Description
Catalog Number:
AG003WA4
Chemical Name:
4-Undecen-3-one, 1,1,1,2,2-pentafluoro-, (E)-
CAS Number:
89176-03-4
Molecular Formula:
C11H15F5O
Molecular Weight:
258.2282
IUPAC Name:
1,1,1,2,2-pentafluoroundec-4-en-3-one
InChI:
InChI=1S/C11H15F5O/c1-2-3-4-5-6-7-8-9(17)10(12,13)11(14,15)16/h7-8H,2-6H2,1H3
InChI Key:
XVNUSLLGJLNBLK-UHFFFAOYSA-N
SMILES:
CCCCCC/C=C/C(=O)C(C(F)(F)F)(F)F
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.104g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.232g/mol
Monoisotopic Mass:
258.104g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.2
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