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Denatonium Benzoate (200 mg)

CAS
86398-53-0
Catalog Number
ACM86398530
Category
Other Products
Molecular Weight
464.596440 [g/mol]
Molecular Formula
C28H36N2O4

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Specification

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;
IUPAC Name
benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium;benzoate;hydrate
Canonical SMILES
CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.C1=CC=C(C=C1)C(=O)[O-].O
InChI Key
YYMVPVZYUYQSJE-UHFFFAOYSA-N
Exact Mass
464.26800
H-Bond Acceptor
4
H-Bond Donor
2
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