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844879-14-7 | 4-BROMO-3',5'-DIMETHYL-4'-METHOXYBENZOPHENONE
CAS No: 844879-14-7 Catalog No: AG004S0L MDL No:
Product Description
Catalog Number:
AG004S0L
Chemical Name:
4-BROMO-3',5'-DIMETHYL-4'-METHOXYBENZOPHENONE
CAS Number:
844879-14-7
Molecular Formula:
C16H15BrO2
Molecular Weight:
319.1931
IUPAC Name:
(4-bromophenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
InChI:
InChI=1S/C16H15BrO2/c1-10-8-13(9-11(2)16(10)19-3)15(18)12-4-6-14(17)7-5-12/h4-9H,1-3H3
InChI Key:
BHJZYHVNIYTBNZ-UHFFFAOYSA-N
SMILES:
COc1c(C)cc(cc1C)C(=O)c1ccc(cc1)Br
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.026g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.198g/mol
Monoisotopic Mass:
318.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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