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Home > Fluorides > 115466-97-2
115466-97-2 | 4'-Ethoxy-2,2,3,3,3-pentafluoropropiophenone
CAS No: 115466-97-2 Catalog No: AG01FAJR MDL No:
Product Description
Catalog Number:
AG01FAJR
Chemical Name:
4'-Ethoxy-2,2,3,3,3-pentafluoropropiophenone
CAS Number:
115466-97-2
Molecular Formula:
C11H9F5O2
Molecular Weight:
268.1800
IUPAC Name:
1-(4-ethoxyphenyl)-2,2,3,3,3-pentafluoropropan-1-one
InChI:
InChI=1S/C11H9F5O2/c1-2-18-8-5-3-7(4-6-8)9(17)10(12,13)11(14,15)16/h3-6H,2H2,1H3
InChI Key:
QDRZLSLQHKCKRU-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)C(=O)C(C(F)(F)F)(F)F
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.183g/mol
Monoisotopic Mass:
268.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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