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Aromatic building blocks

4-Benzyl-4-methylcyclohexanone

Also known as 4-benzyl-4-methylcyclohexan-1-one, 4-benzyl-4-methyl cyclohexanone

CAS 54889-02-0Formula C14H18OMolar mass 202.30 g/mol
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4-Benzyl-4-methylcyclohexanone chemical structure, C14H18O, CAS 54889-02-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
54889-02-0
Formula
C14H18O
Molar mass
202.30 g/mol
HS code
291439
Category
Aromatic building blocks

What is 4-Benzyl-4-methylcyclohexanone?

Plain description, key identifiers and synonyms

4-Benzyl-4-methylcyclohexanone is a chemical substance with the molecular formula C14H18O and a molar mass of 202.30 g/mol. Its CAS registry number is 54889-02-0. The IUPAC name is 4-benzyl-4-methylcyclohexan-1-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-benzyl-4-methylcyclohexan-1-one
CAS number
54889-02-0 CAS number cross-checked
Molecular formula
C14H18O
InChIKey
QTEIPGHFGRLGHG-UHFFFAOYSA-N
InChI
InChI=1S/C14H18O/c1-14(9-7-13(15)8-10-14)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3
SMILES (canonical and isomeric)
CC1(CCC(=O)CC1)CC2=CC=CC=C2

Synonyms

  • 4-benzyl-4-methylcyclohexan-1-one
  • 4-benzyl-4-methyl cyclohexanone

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
202.30 g/molcalc.
Exact mass
202.1358 Dacalc.
LogP (octanol/water)
3.38calc.
Topological polar surface area
17.07 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
1calc.
Rotatable bonds
2calc.
Heavy atoms
15calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.5calc.
Formal charge
0calc.
Stereocentres
0calc.
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=C1CCC(Cc2ccccc2)CC1

O=C1CCC(Cc2ccccc2)CC1

2 rings, 14 atoms, the 4-Benzylcyclohexanone ring system.

19 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.

4-Benzyl-4-methylcyclohexanone suppliers

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4-Benzyl-4-methylcyclohexanone 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

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 4-Benzyl-4-methylcyclohexanone is traded under.

HS 2914.39Indicative HS code

Aromatic ketones without other oxygen function, other

World exports in 2024
$207M
−12.1% vs 2023, imports $191M
2019 to 2024
Top exporters
  1. China61.4%
  2. India * partner reported12.4%
  3. Italy7.6%
Top importers
  1. India * partner reported11.9%
  2. Germany9.9%
  3. United States8.7%

* Partner reported figures, a lower bound.

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

The HS code shown for 4-Benzyl-4-methylcyclohexanone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 4-Benzyl-4-methylcyclohexanone, based on the data on this page

What is 4-Benzyl-4-methylcyclohexanone?

4-Benzyl-4-methylcyclohexanone is a chemical substance with the molecular formula C14H18O and a molar mass of 202.30 g/mol. Its CAS registry number is 54889-02-0. The IUPAC name is 4-benzyl-4-methylcyclohexan-1-one.

What is the CAS number of 4-Benzyl-4-methylcyclohexanone?

The CAS registry number of 4-Benzyl-4-methylcyclohexanone is 54889-02-0.

What is the molecular formula and weight of 4-Benzyl-4-methylcyclohexanone?

The molecular formula of 4-Benzyl-4-methylcyclohexanone is C14H18O and its molar mass is 202.30 g/mol.

What is 4-Benzyl-4-methylcyclohexanone used for?

Known uses and roles of 4-Benzyl-4-methylcyclohexanone include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 4-Benzyl-4-methylcyclohexanone hazardous?

No GHS hazard classification for 4-Benzyl-4-methylcyclohexanone 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 4-Benzyl-4-methylcyclohexanone?

4-Benzyl-4-methylcyclohexanone is usually classified under HS code 291439 (Aromatic ketones without other oxygen function, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 4-Benzyl-4-methylcyclohexanone?

Post a free request on CompoundList and suppliers of 4-Benzyl-4-methylcyclohexanone will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 4-Benzyl-4-methylcyclohexanone?

Suppliers quote 4-Benzyl-4-methylcyclohexanone 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 4-Benzyl-4-methylcyclohexanone

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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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