O-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium tetrafluoroborate

HCID 2733286

Basic information

Standard SMILES
CCOC(=O)C(C#N)=NOC(N(C)C)=[N+](C)C.F[B-](F)(F)F
InChIKey
FPQVGDGSRVMNMR-UHFFFAOYSA-N
Molecular formula
C10H17BF4N4O3
Average molar mass
328.07 g/mol
Monoisotopic mass
328.1329832

Names & identifiers

Preferred name
O-[(Ethoxycarbonyl)cyanomethylenamino]-N,N,N',N'-tetramethyluronium tetrafluoroborate
IUPAC
[[(1-cyano-2-ethoxy-2-oxoethylidene)amino]oxy-(dimethylamino)methylidene]-dimethylazanium tetrafluoroborate

Names & synonyms

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
Show more names
[[(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 tetrafluoroborate

Database identifiers

PubChem CID
2733286

Properties

Computed structural properties

Topological polar surface area
77.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
6
Heavy atoms
22

Related reactions

1,209 records

Linked notes

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