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Home Nitros 7-Fluoro-6-nitro-1H-quinazolin-4-one

7-Fluoro-6-nitro-1H-quinazolin-4-one

CAS No.:
162012-69-3
Catalog Number:
AG001SMN
Molecular Formula:
C8H4FN3O3
Molecular Weight:
209.1341
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$82
- +
100g
98%
In Stock USA
United States
$263
- +
500g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG001SMN
Chemical Name:
7-Fluoro-6-nitro-1H-quinazolin-4-one
CAS Number:
162012-69-3
Molecular Formula:
C8H4FN3O3
Molecular Weight:
209.1341
MDL Number:
MFCD08458874
IUPAC Name:
7-fluoro-6-nitro-3H-quinazolin-4-one
InChI:
InChI=1S/C8H4FN3O3/c9-5-2-6-4(1-7(5)12(14)15)8(13)11-3-10-6/h1-3H,(H,10,11,13)
InChI Key:
VTUAEMSZEIGQRM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2c(=O)[nH]cnc2cc1F
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  
Literature
Title Journal
7-Fluoro-6-nitro-quinazolin-4(3H)-one. Acta crystallographica. Section E, Structure reports online 20091201
Properties