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Home > Fluorides > 100508-56-3
100508-56-3 | 1,3,5-Triazine, 2-(2-fluoro-2,2-dinitroethoxy)-4,6-dimethoxy-
CAS No: 100508-56-3 Catalog No: AG00026U MDL No:
Product Description
Catalog Number:
AG00026U
Chemical Name:
1,3,5-Triazine, 2-(2-fluoro-2,2-dinitroethoxy)-4,6-dimethoxy-
CAS Number:
100508-56-3
Molecular Formula:
C7H8FN5O7
Molecular Weight:
293.1661
IUPAC Name:
2-(2-fluoro-2,2-dinitroethoxy)-4,6-dimethoxy-1,3,5-triazine
InChI:
InChI=1S/C7H8FN5O7/c1-18-4-9-5(19-2)11-6(10-4)20-3-7(8,12(14)15)13(16)17/h3H2,1-2H3
InChI Key:
XSDYWUHPATXNBR-UHFFFAOYSA-N
SMILES:
COc1nc(OCC([N+](=O)[O-])([N+](=O)[O-])F)nc(n1)OC
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.041g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.167g/mol
Monoisotopic Mass:
293.041g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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