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[(E)-3-(dimethylamino)-2-ethoxycarbonyl-4,4-difluorobut-2-enylidene]-dimethylazanium tetrafluoroborate

HCID 178472002
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Basic information

Standard SMILES
CCOC(=O)/C(=C/N(C)C)C(C(F)F)=[N+](C)C.F[B-](F)(F)F
InChIKey
YDBNYXDXNXALEB-UHFFFAOYSA-N
Molecular formula
C11H19BF6N2O2
Average molar mass
336.08 g/mol
Monoisotopic mass
336.144377

Names & identifiers

Preferred name
[(E)-3-(dimethylamino)-2-ethoxycarbonyl-4,4-difluorobut-2-enylidene]-dimethylazanium tetrafluoroborate
IUPAC
[(E)-3-(dimethylamino)-2-ethoxycarbonyl-4,4-difluorobut-2-enylidene]-dimethylazanium tetrafluoroborate

Database identifiers

PubChem CID
44227573

Properties

Computed structural propertiesFilling in

Topological polar surface area
32.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
351

Related reactions

1 records
New reaction record
HRID 547967 reaction equation
HRID 547967As reactantuspto-grants-2011_05

Compound notes

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