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69822-20-4 | Ethanone, 1-[5-bromo-2-(phenylmethoxy)phenyl]-
CAS No: 69822-20-4 Catalog No: AG005HNQ MDL No:
Product Description
Catalog Number:
AG005HNQ
Chemical Name:
Ethanone, 1-[5-bromo-2-(phenylmethoxy)phenyl]-
CAS Number:
69822-20-4
Molecular Formula:
C15H13BrO2
Molecular Weight:
305.1665
IUPAC Name:
1-(5-bromo-2-phenylmethoxyphenyl)ethanone
InChI:
InChI=1S/C15H13BrO2/c1-11(17)14-9-13(16)7-8-15(14)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChI Key:
KXWRALKIRNASMG-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C(=O)C)OCc1ccccc1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.01g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.171g/mol
Monoisotopic Mass:
304.01g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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