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88262-50-4 | 2-Imidazolidinone, 1-[tris(2-fluoro-2,2-dinitroethoxy)methyl]-
CAS No: 88262-50-4 Catalog No: AG004AMB MDL No:
Product Description
Catalog Number:
AG004AMB
Chemical Name:
2-Imidazolidinone, 1-[tris(2-fluoro-2,2-dinitroethoxy)methyl]-
CAS Number:
88262-50-4
Molecular Formula:
C10H11F3N8O16
Molecular Weight:
556.2335
IUPAC Name:
1-[tris(2-fluoro-2,2-dinitroethoxy)methyl]imidazolidin-2-one
InChI:
InChI=1S/C10H11F3N8O16/c11-7(16(23)24,17(25)26)3-35-10(15-2-1-14-6(15)22,36-4-8(12,18(27)28)19(29)30)37-5-9(13,20(31)32)21(33)34/h1-5H2,(H,14,22)
InChI Key:
OKQBYKONACXKTO-UHFFFAOYSA-N
SMILES:
FC([N+](=O)[O-])([N+](=O)[O-])COC(N1CCNC1=O)(OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F
Properties
Complexity:
834
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
556.025g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
19
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
556.233g/mol
Monoisotopic Mass:
556.025g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
335A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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