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150256-28-3 | 6,7-Phthalazinediol
CAS No: 150256-28-3 Catalog No: AG001MG1 MDL No:
Product Description
Catalog Number:
AG001MG1
Chemical Name:
6,7-Phthalazinediol
CAS Number:
150256-28-3
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
IUPAC Name:
phthalazine-6,7-diol
InChI:
InChI=1S/C8H6N2O2/c11-7-1-5-3-9-10-4-6(5)2-8(7)12/h1-4,11-12H
InChI Key:
MGJYLEIAXJSMOS-UHFFFAOYSA-N
SMILES:
Oc1cc2cnncc2cc1O
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
162.148g/mol
Monoisotopic Mass:
162.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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