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Home > Fluorides > 848574-05-0
848574-05-0 | Ethanone, 1-[4-(2,2,2-trifluoro-1-hydroxyethyl)phenyl]-
CAS No: 848574-05-0 Catalog No: AG008G1O MDL No:
Product Description
Catalog Number:
AG008G1O
Chemical Name:
Ethanone, 1-[4-(2,2,2-trifluoro-1-hydroxyethyl)phenyl]-
CAS Number:
848574-05-0
Molecular Formula:
C10H9F3O2
Molecular Weight:
218.1725
IUPAC Name:
1-[4-(2,2,2-trifluoro-1-hydroxyethyl)phenyl]ethanone
InChI:
InChI=1S/C10H9F3O2/c1-6(14)7-2-4-8(5-3-7)9(15)10(11,12)13/h2-5,9,15H,1H3
InChI Key:
HFWQRTPCSSBZAW-UHFFFAOYSA-N
SMILES:
OC(C(F)(F)F)c1ccc(cc1)C(=O)C
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.055g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.175g/mol
Monoisotopic Mass:
218.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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