Denatonium Benzoate Monohydrate

Modify Date: 2025-09-28 14:52:15

Denatonium Benzoate Monohydrate Structure
Denatonium Benzoate Monohydrate structure
Common Name Denatonium Benzoate Monohydrate
CAS Number 86398-53-0 Molecular Weight 464.59600
Density N/A Boiling Point N/A
Molecular Formula C28H36N2O4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium,benzoate,hydrate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C28H36N2O4
Molecular Weight 464.59600
Exact Mass 464.26800
PSA 81.95000
LogP 6.14120
InChIKey YYMVPVZYUYQSJE-UHFFFAOYSA-N
SMILES CC[N+](CC)(CC(=O)Nc1c(C)cccc1C)Cc1ccccc1.O.O=C([O-])c1ccccc1

 Synonyms

4YK5Z54AT2
Benzenemethanaminium,N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-,benzoate,monohydrate
Bitrex (TN)
Denatonium benzoate (NF)
Denatonium benzoate hydrate
UNII-4YK5Z54AT2
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