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Home > Fluorides > 114194-90-0
114194-90-0 | 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(1-hydrazinylideneethyl)-
CAS No: 114194-90-0 Catalog No: AG000ARY MDL No:
Product Description
Catalog Number:
AG000ARY
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(1-hydrazinylideneethyl)-
CAS Number:
114194-90-0
Molecular Formula:
C6H7FN4O2
Molecular Weight:
186.1438
IUPAC Name:
1-ethanehydrazonoyl-5-fluoropyrimidine-2,4-dione
InChI:
InChI=1S/C6H7FN4O2/c1-3(10-8)11-2-4(7)5(12)9-6(11)13/h2H,8H2,1H3,(H,9,12,13)
InChI Key:
ZTOJSMBBAKKAJM-UHFFFAOYSA-N
SMILES:
CC(=NN)n1cc(F)c(=O)[nH]c1=O
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.146g/mol
Monoisotopic Mass:
186.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-1.2
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