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21221-93-2 | (3,5-Bis(trifluoromethyl);phenyl);(phenyl);methanone
CAS No: 21221-93-2 Catalog No: AG003IK0 MDL No:MFCD00015510
Product Description
Catalog Number:
AG003IK0
Chemical Name:
(3,5-Bis(trifluoromethyl);phenyl);(phenyl);methanone
CAS Number:
21221-93-2
Molecular Formula:
C15H8F6O
Molecular Weight:
318.2138
MDL Number:
MFCD00015510
IUPAC Name:
[3,5-bis(trifluoromethyl)phenyl]-phenylmethanone
InChI:
InChI=1S/C15H8F6O/c16-14(17,18)11-6-10(7-12(8-11)15(19,20)21)13(22)9-4-2-1-3-5-9/h1-8H
InChI Key:
QETSMUIBVUASOJ-UHFFFAOYSA-N
SMILES:
O=C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccccc1
EC Number:
244-282-5
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.048g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.218g/mol
Monoisotopic Mass:
318.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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