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263365-51-1 | 4H-1-Benzopyran-4-one, 2-(2,4-dimethoxyphenyl)-3-hydroxy-7-methoxy-
CAS No: 263365-51-1 Catalog No: AG002SSL MDL No:
Product Description
Catalog Number:
AG002SSL
Chemical Name:
4H-1-Benzopyran-4-one, 2-(2,4-dimethoxyphenyl)-3-hydroxy-7-methoxy-
CAS Number:
263365-51-1
Molecular Formula:
C18H16O6
Molecular Weight:
328.3160
IUPAC Name:
2-(2,4-dimethoxyphenyl)-3-hydroxy-7-methoxychromen-4-one
InChI:
InChI=1S/C18H16O6/c1-21-10-5-7-13(14(8-10)23-3)18-17(20)16(19)12-6-4-11(22-2)9-15(12)24-18/h4-9,20H,1-3H3
InChI Key:
CPSQIOPVWINXFH-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC)c1oc2cc(OC)ccc2c(=O)c1O
Properties
Complexity:
502
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.095g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.32g/mol
Monoisotopic Mass:
328.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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