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21084-23-1 | Methanone, (4-bromophenyl)[4-(trifluoromethyl)phenyl]-
CAS No: 21084-23-1 Catalog No: AG002L0A MDL No:MFCD12569067
Product Description
Catalog Number:
AG002L0A
Chemical Name:
Methanone, (4-bromophenyl)[4-(trifluoromethyl)phenyl]-
CAS Number:
21084-23-1
Molecular Formula:
C14H8BrF3O
Molecular Weight:
329.1119
MDL Number:
MFCD12569067
IUPAC Name:
(4-bromophenyl)-[4-(trifluoromethyl)phenyl]methanone
InChI:
InChI=1S/C14H8BrF3O/c15-12-7-3-10(4-8-12)13(19)9-1-5-11(6-2-9)14(16,17)18/h1-8H
InChI Key:
WBTNCOKTRQISPJ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=O)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.971g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.116g/mol
Monoisotopic Mass:
327.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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