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Acid, base and phase-transfer catalysts

Denatonium hydroxide

Also known as N-{2-[(2,6-dimethylphenyl)-amino]-2-oxoethyl}-N,N-diethyl-benzenemethanaminium hydroxide

CAS 222608-06-2Formula C21H30N2O2Molar mass 342.48 g/mol
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Denatonium hydroxide chemical structure, C21H30N2O2, CAS 222608-06-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
222608-06-2
Formula
C21H30N2O2
Molar mass
342.48 g/mol
HS code
292429
Category
Acid, base and phase-transfer catalysts

What is Denatonium hydroxide?

Plain description, key identifiers and synonyms

Denatonium hydroxide is a chemical substance with the molecular formula C21H30N2O2 and a molar mass of 342.48 g/mol. Its CAS registry number is 222608-06-2. The IUPAC name is benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium hydroxide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium hydroxide
CAS number
222608-06-2
Molecular formula
C21H30N2O2
InChIKey
XJUUDTMUUDAAPP-UHFFFAOYSA-N
InChI
InChI=1S/C21H28N2O.H2O/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;/h7-14H,5-6,15-16H2,1-4H3;1H2
SMILES (canonical and isomeric)
CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.[OH-]

Synonyms

  • N-{2-[(2,6-dimethylphenyl)-amino]-2-oxoethyl}-N,N-diethyl-benzenemethanaminium hydroxide

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
342.48 g/molcalc.
Exact mass
342.2307 Dacalc.
LogP (octanol/water)
4.12calc.
Topological polar surface area
59.1 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
7calc.
Heavy atoms
25calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.38calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
2calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(CNCc1ccccc1)Nc1ccccc1

O=C(CNCc1ccccc1)Nc1ccccc1

2 rings, 18 atoms.

114 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Denatonium hydroxide suppliers

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Denatonium hydroxide price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Denatonium hydroxide is traded under.

HS 2924.29Indicative HS code

Cyclic amides (including cyclic carbamates) and their derivatives, salts thereof, other

World exports in 2024
$5.69B
−5.1% vs 2023, imports $5.8B
2019 to 2024
Top exporters
  1. China32.3%
  2. Switzerland * partner reported13.6%
  3. Norway * partner reported12.8%
Top importers
  1. United States15.9%
  2. Ireland15.8%
  3. Germany11.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Denatonium hydroxide is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Denatonium hydroxide, based on the data on this page

What is Denatonium hydroxide?

Denatonium hydroxide is a chemical substance with the molecular formula C21H30N2O2 and a molar mass of 342.48 g/mol. Its CAS registry number is 222608-06-2. The IUPAC name is benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium hydroxide.

What is the CAS number of Denatonium hydroxide?

The CAS registry number of Denatonium hydroxide is 222608-06-2.

What is the molecular formula and weight of Denatonium hydroxide?

The molecular formula of Denatonium hydroxide is C21H30N2O2 and its molar mass is 342.48 g/mol.

Is Denatonium hydroxide hazardous?

No GHS hazard classification for Denatonium hydroxide is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Denatonium hydroxide?

Denatonium hydroxide is usually classified under HS code 292429 (Cyclic amides (including cyclic carbamates) and their derivatives, salts thereof, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Denatonium hydroxide?

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What is the price of Denatonium hydroxide?

Suppliers quote Denatonium hydroxide on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Denatonium hydroxide

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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