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898761-25-6 | 3'-Bromo-3-(4-bromophenyl)propiophenone
CAS No: 898761-25-6 Catalog No: AG01EYUX MDL No:
Product Description
Catalog Number:
AG01EYUX
Chemical Name:
3'-Bromo-3-(4-bromophenyl)propiophenone
CAS Number:
898761-25-6
Molecular Formula:
C15H12Br2O
Molecular Weight:
368.0632
IUPAC Name:
1-(3-bromophenyl)-3-(4-bromophenyl)propan-1-one
InChI:
InChI=1S/C15H12Br2O/c16-13-7-4-11(5-8-13)6-9-15(18)12-2-1-3-14(17)10-12/h1-5,7-8,10H,6,9H2
InChI Key:
WAZXRZVOMNGRFV-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)CCC(=O)c1cccc(c1)Br
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.923g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.068g/mol
Monoisotopic Mass:
365.925g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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