Molecular Identity
Denatonium Benzoate
benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium benzoate
PubChem CID: 19518
2D Structure
Properties
C28H34N2O3
Molecular Formula
446.60
Molecular Weight
g/mol
446.2569
Exact Mass
Da
69.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
473
Complexity
SMILES
Canonical SMILES
SMILES: CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.C1=CC=C(C=C1)C(=O)[O-]Isomeric SMILES
SMILES: CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.C1=CC=C(C=C1)C(=O)[O-]Synonyms(20)
DENATONIUM BENZOATE3734-33-6BitrexLidocaine benzyl benzoateAversionTHS-839AnisprayGoriBenzoato de denatonioBenzoate de denatoniumDenatonium benzoate anhydrousDenatonii benzoasWIN 16568DTXSID8034376Lignocaine benzyl benzoate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Denatonium Benzoate
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