Home Nitros 7-fluoro-8-nitroquinazolin-4-ol

7-fluoro-8-nitroquinazolin-4-ol

CAS No.:
1027929-81-2
Catalog Number:
AG0096DB
Molecular Formula:
C8H4FN3O3
Molecular Weight:
209.1341
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Product Description
Catalog Number:
AG0096DB
Chemical Name:
7-fluoro-8-nitroquinazolin-4-ol
CAS Number:
1027929-81-2
Molecular Formula:
C8H4FN3O3
Molecular Weight:
209.1341
MDL Number:
MFCD30566227
IUPAC Name:
7-fluoro-8-nitro-3H-quinazolin-4-one
InChI:
InChI=1S/C8H4FN3O3/c9-5-2-1-4-6(7(5)12(14)15)10-3-11-8(4)13/h1-3H,(H,10,11,13)
InChI Key:
CJBKDJKOXRYRRV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(F)ccc2c1nc[nH]c2=O
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.024g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.136g/mol
Monoisotopic Mass:
209.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties