Name: [[(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium tetrafluoroborate
SMILES:
[B-](F)(F)(F)F.CCOC(=O)C(=NOC(=[N+](C)C)N(C)C)C#NMolecular Processing
Molecular formula
C10H17BF4N4O3
Molecular weight
328.08
Exact mass
328.133
XLogP
0.94
TPSA
77.93
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
2
Fraction Csp3
0.6
Molar refractivity
71.75
Supplementary Information
InChIKey: FPQVGDGSRVMNMR-UHFFFAOYSA-N
Synonyme
TOTUO-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium tetrafluoroborateo-((ethoxycarbonyl)cyanomethyleneamino)-n,n,n',n'-tetramethyluronium tetrafluoroborate[[(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium;tetrafluoroborateo-[(ethoxycarbonyl)cyanomethyleneamino]-n,n,n',n'-tetramethyluronium tetrafluoroborateN-(6-Cyano-2-methyl-7-oxo-4,8-dioxa-2,5-diazadec-5-en-3-ylidene)-N-methylmethanaminium tetrafluoroborateMFCD00192127o-((cyano(ethoxycarbonyl)methylene)amino)-1,1,3,3-tetramethyluronium tetrafluoroborateO-[(cyano(ethoxycarbonyl)methylene)amino]-1,1,3,3-tetramethyluronium tetrafluoroborateSCHEMBL120244SCHEMBL221988FPQVGDGSRVMNMR-UHFFFAOYSA-N[[(Z)-(1-cyano-2-ethoxy-2-oxo-ethylidene)amino]oxy-(dimethylamino)methylene]-dimethyl-ammonium;tetrafluoroborateAKOS024386580FT15567AC-24886E0916ST51038262[(cyano(ethoxycarbonyl)methylidene)amino]-1,1,3,3,-tetramethyluronium tetrafluoroborateO-((cyano-(ethoxycarbonyl)-methylidene)amino)-1,1,3,3-tetramethylu ronium tetrafluoroborateO-((cyano-(ethoxycarbonyl)-methylidene)amino)-1,1,3,3-tetramethyluronium tetrafluoroborateO-(cyano(ethoxycarbonyl)methyleneamino)-N,N,N',N'-tetramethyluronium tetrafluoroborateO-[(cyano(ethoxycarbonyl)methylene)amino]1,1,3,3-tetramethyluronium tetrafluoroborateO-[(cyano(ethoxycarbonyl)methylidene)amino]-1,1,3,3-tetramethyluronium tetrafluoroborateO-[(cyano-(ethoxycarbonyl)methylene)amino]-1,1,3,3-tetramethyluronium tetrafluoroborateO-[(ethoxycarbonyl)-cyanomethylenamino]-N,N, N',N'-tetramethyluronium tetrafluoroborateO-[(ethoxycarbonyl)-cyanomethylenamino]-N,N,N',N'-tetramethyluronium tetrafluoroborateO-[(ethoxycarbonyl)-cyanomethyleneamino]-N,N,N',N'-tetramethyluronium tetrafluoroborateO-[(ethoxycarbonyl)cyano-methyleneamino]-N,N,N',N'-tetramethyluronium tetrafluoroborateO-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetra methyluroniumtetrafluoroborate
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