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898782-48-4 | 3-(3-Bromophenyl)-4'-fluoropropiophenone
CAS No: 898782-48-4 Catalog No: AG01EYXG MDL No:
Product Description
Catalog Number:
AG01EYXG
Chemical Name:
3-(3-Bromophenyl)-4'-fluoropropiophenone
CAS Number:
898782-48-4
Molecular Formula:
C15H12BrFO
Molecular Weight:
307.1576
IUPAC Name:
3-(3-bromophenyl)-1-(4-fluorophenyl)propan-1-one
InChI:
InChI=1S/C15H12BrFO/c16-13-3-1-2-11(10-13)4-9-15(18)12-5-7-14(17)8-6-12/h1-3,5-8,10H,4,9H2
InChI Key:
AZAZHHBUIXJGDC-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(=O)CCc1cccc(c1)Br
Properties
Complexity:
274
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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