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94355-81-4 | 2,4-Dihydroxybenzaldehyde 9-acridinylhydrazone
CAS No: 94355-81-4 Catalog No: AG005Z0Y MDL No:
Product Description
Catalog Number:
AG005Z0Y
Chemical Name:
2,4-Dihydroxybenzaldehyde 9-acridinylhydrazone
CAS Number:
94355-81-4
Molecular Formula:
C20H15N3O2
Molecular Weight:
329.3520
IUPAC Name:
4-[(E)-(acridin-9-ylhydrazinylidene)methyl]benzene-1,3-diol
InChI:
InChI=1S/C20H15N3O2/c24-14-10-9-13(19(25)11-14)12-21-23-20-15-5-1-3-7-17(15)22-18-8-4-2-6-16(18)20/h1-12,24-25H,(H,22,23)/b21-12+
InChI Key:
KQSSMFSWWMFINC-CIAFOILYSA-N
SMILES:
Oc1ccc(c(c1)O)C=NNc1c2ccccc2nc2c1cccc2
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
329.116g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
329.359g/mol
Monoisotopic Mass:
329.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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