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204197-90-0 | 1-Propanone, 2-(4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)-
CAS No: 204197-90-0 Catalog No: AG0029BO MDL No:
Product Description
Catalog Number:
AG0029BO
Chemical Name:
1-Propanone, 2-(4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)-
CAS Number:
204197-90-0
Molecular Formula:
C16H16O5
Molecular Weight:
288.2952
IUPAC Name:
2-(4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one
InChI:
InChI=1S/C16H16O5/c1-9(10-3-5-12(21-2)6-4-10)16(20)15-13(18)7-11(17)8-14(15)19/h3-9,17-19H,1-2H3
InChI Key:
UDALNYNLNYDPMV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(C(=O)c1c(O)cc(cc1O)O)C
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.1g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
288.299g/mol
Monoisotopic Mass:
288.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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