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114590-62-4 | 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-(2-hydroxyphenyl)-
CAS No: 114590-62-4 Catalog No: AG000ERR MDL No:
Product Description
Catalog Number:
AG000ERR
Chemical Name:
2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-(2-hydroxyphenyl)-
CAS Number:
114590-62-4
Molecular Formula:
C15H10O5
Molecular Weight:
270.2369
IUPAC Name:
5,7-dihydroxy-4-(2-hydroxyphenyl)chromen-2-one
InChI:
InChI=1S/C15H10O5/c16-8-5-12(18)15-10(7-14(19)20-13(15)6-8)9-3-1-2-4-11(9)17/h1-7,16-18H
InChI Key:
STTFUJUCFPJSOI-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c2c(c1)oc(=O)cc2c1ccccc1O
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.053g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
270.24g/mol
Monoisotopic Mass:
270.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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