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13300-25-9 | 4(1H)-Quinazolinone, 1-hydroxy-
CAS No: 13300-25-9 Catalog No: AG0011IU MDL No:
Product Description
Catalog Number:
AG0011IU
Chemical Name:
4(1H)-Quinazolinone, 1-hydroxy-
CAS Number:
13300-25-9
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
IUPAC Name:
1-hydroxyquinazolin-4-one
InChI:
InChI=1S/C8H6N2O2/c11-8-6-3-1-2-4-7(6)10(12)5-9-8/h1-5,12H
InChI Key:
RSVNNOYCPQKYSQ-UHFFFAOYSA-N
SMILES:
On1cnc(=O)c2c1cccc2
Properties
Complexity:
227
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:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.148g/mol
Monoisotopic Mass:
162.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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