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898761-40-5 | 3-(4-Bromophenyl)-4'-fluoropropiophenone
CAS No: 898761-40-5 Catalog No: AG01EYV1 MDL No:
Product Description
Catalog Number:
AG01EYV1
Chemical Name:
3-(4-Bromophenyl)-4'-fluoropropiophenone
CAS Number:
898761-40-5
Molecular Formula:
C15H12BrFO
Molecular Weight:
307.1576
IUPAC Name:
3-(4-bromophenyl)-1-(4-fluorophenyl)propan-1-one
InChI:
InChI=1S/C15H12BrFO/c16-13-6-1-11(2-7-13)3-10-15(18)12-4-8-14(17)9-5-12/h1-2,4-9H,3,10H2
InChI Key:
QKWBZXRHYHGLHX-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(=O)CCc1ccc(cc1)Br
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.006g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.162g/mol
Monoisotopic Mass:
306.006g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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