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89762-23-2 | 4H-1-Benzopyran-3,4,5,7-tetrol, 2-(2,4-dihydroxyphenyl)-
CAS No: 89762-23-2 Catalog No: AG003ZRN MDL No:
Product Description
Catalog Number:
AG003ZRN
Chemical Name:
4H-1-Benzopyran-3,4,5,7-tetrol, 2-(2,4-dihydroxyphenyl)-
CAS Number:
89762-23-2
Molecular Formula:
C15H12O7
Molecular Weight:
304.2516
IUPAC Name:
2-(2,4-dihydroxyphenyl)-4H-chromene-3,4,5,7-tetrol
InChI:
InChI=1S/C15H12O7/c16-6-1-2-8(9(18)3-6)15-14(21)13(20)12-10(19)4-7(17)5-11(12)22-15/h1-5,13,16-21H
InChI Key:
VBXOQEGVKHOQEV-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)O)C1=C(O)C(c2c(O1)cc(O)cc2O)O
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.058g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
304.254g/mol
Monoisotopic Mass:
304.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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