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Aldehydes and ketones

beta,4-Dimethylcyclohexanepropionaldehyde

Also known as 3-(4-methylcyclohexyl)butanal

CAS 70964-95-3Formula C11H20OMolar mass 168.28 g/molEC 275-066-9
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beta,4-Dimethylcyclohexanepropionaldehyde chemical structure, C11H20O, CAS 70964-95-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
70964-95-3
Formula
C11H20O
Molar mass
168.28 g/mol
EC number
275-066-9
HS code
291229
Category
Aldehydes and ketones

What is beta,4-Dimethylcyclohexanepropionaldehyde?

Plain description, key identifiers and synonyms

beta,4-Dimethylcyclohexanepropionaldehyde is a chemical substance with the molecular formula C11H20O and a molar mass of 168.28 g/mol. Its CAS registry number is 70964-95-3. The IUPAC name is 3-(4-methylcyclohexyl)butanal.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-(4-methylcyclohexyl)butanal
CAS number
70964-95-3 CAS number cross-checked
EC number
275-066-9
Molecular formula
C11H20O
InChIKey
YZFPDESEFZSBIN-UHFFFAOYSA-N
InChI
InChI=1S/C11H20O/c1-9-3-5-11(6-4-9)10(2)7-8-12/h8-11H,3-7H2,1-2H3
SMILES (canonical and isomeric)
CC1CCC(CC1)C(C)CC=O

Synonyms

  • 3-(4-methylcyclohexyl)butanal

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
168.28 g/molcalc.
Exact mass
168.1514 Dacalc.
LogP (octanol/water)
3.04calc.
Topological polar surface area
17.07 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
1calc.
Rotatable bonds
3calc.
Heavy atoms
12calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.91calc.
Formal charge
0calc.
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, C1CCCCC1

C1CCCCC1

1 ring, 6 atoms, the Cyclohexane ring system.

24,737 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.

beta,4-Dimethylcyclohexanepropionaldehyde suppliers

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beta,4-Dimethylcyclohexanepropionaldehyde price

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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 beta,4-Dimethylcyclohexanepropionaldehyde is traded under.

HS 2912.29Indicative HS code

Cyclic aldehydes without other oxygen function, other

World exports in 2024
$435M
+19.0% vs 2023, imports $484M
2019 to 2024
Top exporters
  1. China19.5%
  2. Japan17.4%
  3. India * partner reported13.0%
Top importers
  1. United States22.5%
  2. China9.2%
  3. Singapore8.4%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about beta,4-Dimethylcyclohexanepropionaldehyde, based on the data on this page

What is beta,4-Dimethylcyclohexanepropionaldehyde?

beta,4-Dimethylcyclohexanepropionaldehyde is a chemical substance with the molecular formula C11H20O and a molar mass of 168.28 g/mol. Its CAS registry number is 70964-95-3. The IUPAC name is 3-(4-methylcyclohexyl)butanal.

What is the CAS number of beta,4-Dimethylcyclohexanepropionaldehyde?

The CAS registry number of beta,4-Dimethylcyclohexanepropionaldehyde is 70964-95-3.

What is the molecular formula and weight of beta,4-Dimethylcyclohexanepropionaldehyde?

The molecular formula of beta,4-Dimethylcyclohexanepropionaldehyde is C11H20O and its molar mass is 168.28 g/mol.

What is beta,4-Dimethylcyclohexanepropionaldehyde used for?

Known uses and roles of beta,4-Dimethylcyclohexanepropionaldehyde include building blocks in research and laboratory and screening compounds in research and laboratory.

Is beta,4-Dimethylcyclohexanepropionaldehyde hazardous?

No GHS hazard classification for beta,4-Dimethylcyclohexanepropionaldehyde 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 beta,4-Dimethylcyclohexanepropionaldehyde?

beta,4-Dimethylcyclohexanepropionaldehyde is usually classified under HS code 291229 (Cyclic aldehydes without other oxygen function, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy beta,4-Dimethylcyclohexanepropionaldehyde?

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

What is the price of beta,4-Dimethylcyclohexanepropionaldehyde?

Suppliers quote beta,4-Dimethylcyclohexanepropionaldehyde 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 beta,4-Dimethylcyclohexanepropionaldehyde

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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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