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16052-81-6 | 2H,5H-Pyrano[3,2-c][1]benzopyran-2,5-dione, 4-hydroxy-
CAS No: 16052-81-6 Catalog No: AG001S0E MDL No:
Product Description
Catalog Number:
AG001S0E
Chemical Name:
2H,5H-Pyrano[3,2-c][1]benzopyran-2,5-dione, 4-hydroxy-
CAS Number:
16052-81-6
Molecular Formula:
C12H6O5
Molecular Weight:
230.1730
IUPAC Name:
4-hydroxypyrano[3,2-c]chromene-2,5-dione
InChI:
InChI=1S/C12H6O5/c13-7-5-9(14)17-11-6-3-1-2-4-8(6)16-12(15)10(7)11/h1-5,13H
InChI Key:
SEUYEPDUKPAJOJ-UHFFFAOYSA-N
SMILES:
O=c1cc(O)c2c(o1)c1ccccc1oc2=O
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.022g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.175g/mol
Monoisotopic Mass:
230.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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