200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 99768-67-9
99768-67-9 | 5-Nitroquinazolin-4-ol
CAS No: 99768-67-9 Catalog No: AG003MWW MDL No:MFCD12198902
Product Description
Catalog Number:
AG003MWW
Chemical Name:
5-Nitroquinazolin-4-ol
CAS Number:
99768-67-9
Molecular Formula:
C8H5N3O3
Molecular Weight:
191.1436
MDL Number:
MFCD12198902
IUPAC Name:
5-nitro-3H-quinazolin-4-one
InChI:
InChI=1S/C8H5N3O3/c12-8-7-5(9-4-10-8)2-1-3-6(7)11(13)14/h1-4H,(H,9,10,12)
InChI Key:
AGOKBMXSQJZEKF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1c(O)ncn2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.146g/mol
Monoisotopic Mass:
191.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.