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Home > Fluorides > 1007308-74-8
1007308-74-8 | 2,4(1H,3H)-Quinazolinedione, 7-fluoro-6-nitro-
CAS No: 1007308-74-8 Catalog No: AG0002PZ MDL No:MFCD11858258
Product Description
Catalog Number:
AG0002PZ
Chemical Name:
2,4(1H,3H)-Quinazolinedione, 7-fluoro-6-nitro-
CAS Number:
1007308-74-8
Molecular Formula:
C8H4FN3O4
Molecular Weight:
225.1335
MDL Number:
MFCD11858258
IUPAC Name:
7-fluoro-6-nitro-1H-quinazoline-2,4-dione
InChI:
InChI=1S/C8H4FN3O4/c9-4-2-5-3(1-6(4)12(15)16)7(13)11-8(14)10-5/h1-2H,(H2,10,11,13,14)
InChI Key:
LXSGVXDLSKJWDH-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)c2c([nH]1)cc(c(c2)[N+](=O)[O-])F
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.019g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.135g/mol
Monoisotopic Mass:
225.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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