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898760-36-6 | 4'-Bromo-3-(3-bromophenyl)-3'-fluoropropiophenone
CAS No: 898760-36-6 Catalog No: AG01EYTU MDL No:
Product Description
Catalog Number:
AG01EYTU
Chemical Name:
4'-Bromo-3-(3-bromophenyl)-3'-fluoropropiophenone
CAS Number:
898760-36-6
Molecular Formula:
C15H11Br2FO
Molecular Weight:
386.0536
IUPAC Name:
1-(4-bromo-3-fluorophenyl)-3-(3-bromophenyl)propan-1-one
InChI:
InChI=1S/C15H11Br2FO/c16-12-3-1-2-10(8-12)4-7-15(19)11-5-6-13(17)14(18)9-11/h1-3,5-6,8-9H,4,7H2
InChI Key:
UPCXGFNIAPLZFU-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)CCC(=O)c1ccc(c(c1)F)Br
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.914g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.058g/mol
Monoisotopic Mass:
383.916g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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