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88262-51-5 | 2-Imidazolidinone, 1-nitro-3-[tris(2-fluoro-2,2-dinitroethoxy)methyl]-
CAS No: 88262-51-5 Catalog No: AG004BZZ MDL No:
Product Description
Catalog Number:
AG004BZZ
Chemical Name:
2-Imidazolidinone, 1-nitro-3-[tris(2-fluoro-2,2-dinitroethoxy)methyl]-
CAS Number:
88262-51-5
Molecular Formula:
C10H10F3N9O18
Molecular Weight:
601.2311
IUPAC Name:
1-nitro-3-[tris(2-fluoro-2,2-dinitroethoxy)methyl]imidazolidin-2-one
InChI:
InChI=1S/C10H10F3N9O18/c11-7(16(24)25,17(26)27)3-38-10(14-1-2-15(6(14)23)22(36)37,39-4-8(12,18(28)29)19(30)31)40-5-9(13,20(32)33)21(34)35/h1-5H2
InChI Key:
QMGVIYTZKRVVNQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)N1CCN(C1=O)C(OCC([N+](=O)[O-])([N+](=O)[O-])F)(OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F
Properties
Complexity:
954
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
601.01g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
21
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
601.23g/mol
Monoisotopic Mass:
601.01g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
372A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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