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Home > Fluorides > 100508-57-4
100508-57-4 | 1,3,5-Triazine, 2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-
CAS No: 100508-57-4 Catalog No: AG00026T MDL No:
Product Description
Catalog Number:
AG00026T
Chemical Name:
1,3,5-Triazine, 2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-
CAS Number:
100508-57-4
Molecular Formula:
C8H7F2N7O11
Molecular Weight:
415.1783
IUPAC Name:
2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-1,3,5-triazine
InChI:
InChI=1S/C8H7F2N7O11/c1-26-4-11-5(27-2-7(9,14(18)19)15(20)21)13-6(12-4)28-3-8(10,16(22)23)17(24)25/h2-3H2,1H3
InChI Key:
MWDAMNNZTWJXEP-UHFFFAOYSA-N
SMILES:
COc1nc(OCC([N+](=O)[O-])([N+](=O)[O-])F)nc(n1)OCC([N+](=O)[O-])([N+](=O)[O-])F
Properties
Complexity:
538
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
415.017g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
16
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
415.179g/mol
Monoisotopic Mass:
415.017g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
250A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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