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189619-46-3 | 2H-1-Benzopyran-2-one, 6-[2-(2,3-dihydroxy-1-naphthalenyl)diazenyl]-
CAS No: 189619-46-3 Catalog No: AG002DSS MDL No:
Product Description
Catalog Number:
AG002DSS
Chemical Name:
2H-1-Benzopyran-2-one, 6-[2-(2,3-dihydroxy-1-naphthalenyl)diazenyl]-
CAS Number:
189619-46-3
Molecular Formula:
C19H12N2O4
Molecular Weight:
332.3096
IUPAC Name:
6-[(2,3-dihydroxynaphthalen-1-yl)diazenyl]chromen-2-one
InChI:
InChI=1S/C19H12N2O4/c22-15-10-11-3-1-2-4-14(11)18(19(15)24)21-20-13-6-7-16-12(9-13)5-8-17(23)25-16/h1-10,22,24H
InChI Key:
OGNOSKXCCOWXCM-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(o1)ccc(c2)N=Nc1c(O)c(O)cc2c1cccc2
Properties
Complexity:
564
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.08g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
332.315g/mol
Monoisotopic Mass:
332.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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