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28560-95-4

28560-95-4 | Spiro[3H-indazole-3,9'-[9H]xanthene]-4,7-diol

CAS No: 28560-95-4 Catalog No: AG002VPQ MDL No:

Product Description

Catalog Number:
AG002VPQ
Chemical Name:
Spiro[3H-indazole-3,9'-[9H]xanthene]-4,7-diol
CAS Number:
28560-95-4
Molecular Formula:
C19H12N2O3
Molecular Weight:
316.3102
IUPAC Name:
spiro[indazole-3,9'-xanthene]-4,7-diol
InChI:
InChI=1S/C19H12N2O3/c22-13-9-10-14(23)18-17(13)19(21-20-18)11-5-1-3-7-15(11)24-16-8-4-2-6-12(16)19/h1-10,22-23H
InChI Key:
WZGLLGFNWAQZNW-UHFFFAOYSA-N
SMILES:
Oc1ccc(c2c1C1(N=N2)c2ccccc2Oc2c1cccc2)O
UNII:
6I6M7ZP54K
NSC Number:
403500

Properties

Complexity:
503  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.085g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
316.316g/mol
Monoisotopic Mass:
316.085g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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