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Acid, base and phase-transfer catalysts

Tridihexethyl

Also known as Propethonum, Tridihexethyl ion, Tridihexethyl cation

CAS 60-49-1Formula C21H36NO+Molar mass 318.53 g/mol
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Tridihexethyl chemical structure, C21H36NO+, CAS 60-49-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
60-49-1
Formula
C21H36NO+
Molar mass
318.53 g/mol
HS code
292390
Category
Acid, base and phase-transfer catalysts

What is Tridihexethyl?

Plain description, key identifiers and synonyms

Tridihexethyl is a tertiary alcohol and a quaternary ammonium ion. It has a role as a muscarinic antagonist, an anti-ulcer drug and an antispasmodic drug.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium
CAS number
60-49-1 CAS number cross-checked
Molecular formula
C21H36NO+
UNII
7HE50A367X
InChIKey
NPRHVSBSZMAEIN-UHFFFAOYSA-N
InChI
InChI=1S/C21H36NO/c1-4-22(5-2,6-3)18-17-21(23,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7,9-10,13-14,20,23H,4-6,8,11-12,15-18H2,1-3H3/q+1
SMILES (canonical and isomeric)
CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O

Synonyms

  • Propethonum
  • Tridihexethyl ion
  • Tridihexethyl cation
  • (3-cyclohexyl-3-hydroxy-3-phenylpropyl)triethylazanium
  • Benzenepropanaminium, gamma-cyclohexyl-N,N,N-triethyl-gamma-hydroxy-
  • chloride of tridihexethyl
  • (3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium
  • 3-cyclohexyl-N,N,N-triethyl-3-hydroxy-3-phenylpropan-1-aminium
  • (3-Cyclohexyl-3-hydroxy-3-phenylpropyl)triethylammonium

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
318.53 g/molcalc.
Exact mass
318.2791 Dacalc.
LogP (octanol/water)
4.72calc.
Topological polar surface area
20.23 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
1calc.
Rotatable bonds
8calc.
Heavy atoms
23calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.71calc.
Formal charge
1calc.
Stereocentres
1calc.
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, c1ccc(CC2CCCCC2)cc1

c1ccc(CC2CCCCC2)cc1

2 rings, 13 atoms, the Benzene, (cyclohexylmethyl)- ring system.

991 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.

Tridihexethyl suppliers

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Tridihexethyl 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

Roles

  • anti-ulcer drug
  • antispasmodic drug
  • cholinergic antagonist
  • cholinergic drug
  • muscarinic antagonist
  • muscle relaxant
  • neuromuscular agent
  • neurotransmitter agent
  • pharmaceutical

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 Tridihexethyl is traded under.

HS 2923.90Indicative HS code

Quaternary ammonium salts and hydroxides whether or not chemically defined not elsewhere classified…

World exports in 2024
$1.07B
+14.4% vs 2023, imports $1.16B
2019 to 2024
Top exporters
  1. China36.7%
  2. United States14.2%
  3. Netherlands9.4%
Top importers
  1. South Korea10.7%
  2. Germany10.1%
  3. United States9.9%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Tridihexethyl, based on the data on this page

What is Tridihexethyl?

Tridihexethyl is a tertiary alcohol and a quaternary ammonium ion. It has a role as a muscarinic antagonist, an anti-ulcer drug and an antispasmodic drug.

What is the CAS number of Tridihexethyl?

The CAS registry number of Tridihexethyl is 60-49-1.

What is the molecular formula and weight of Tridihexethyl?

The molecular formula of Tridihexethyl is C21H36NO+ and its molar mass is 318.53 g/mol.

What is Tridihexethyl used for?

Known uses and roles of Tridihexethyl include anti-ulcer drug, antispasmodic drug, cholinergic antagonist, cholinergic drug, muscarinic antagonist and 4 more.

Is Tridihexethyl hazardous?

No GHS hazard classification for Tridihexethyl 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 Tridihexethyl?

Tridihexethyl is usually classified under HS code 292390 (Quaternary ammonium salts and hydroxides, lecithins and other phosphoaminolipids…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Tridihexethyl?

Post a free request on CompoundList and suppliers of Tridihexethyl will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Tridihexethyl?

Suppliers quote Tridihexethyl 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 Tridihexethyl

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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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