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143999-64-8 | 1-Propanone, 1-phenyl-3-(2,4,6-trihydroxyphenyl)-
CAS No: 143999-64-8 Catalog No: AG001IQ9 MDL No:
Product Description
Catalog Number:
AG001IQ9
Chemical Name:
1-Propanone, 1-phenyl-3-(2,4,6-trihydroxyphenyl)-
CAS Number:
143999-64-8
Molecular Formula:
C15H14O4
Molecular Weight:
258.2693
IUPAC Name:
1-phenyl-3-(2,4,6-trihydroxyphenyl)propan-1-one
InChI:
InChI=1S/C15H14O4/c16-11-8-14(18)12(15(19)9-11)6-7-13(17)10-4-2-1-3-5-10/h1-5,8-9,16,18-19H,6-7H2
InChI Key:
MJMLIDPLFUKOQV-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c(c(c1)O)CCC(=O)c1ccccc1
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.089g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
258.273g/mol
Monoisotopic Mass:
258.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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