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Aldehydes and ketones

4-Isopropoxycyclohexanone

Also known as 4-(propan-2-yloxy)cyclohexan-1-one, 4-propan-2-yloxycyclohexan-1-one, 4-isopropoxy-cyclohexanone

CAS 69697-46-7Formula C9H16O2Molar mass 156.23 g/molEC 807-231-3
GHS signal word: Warning. Pictograms: Harmful or irritant
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4-Isopropoxycyclohexanone chemical structure, C9H16O2, CAS 69697-46-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
69697-46-7
Formula
C9H16O2
Molar mass
156.23 g/mol
EC number
807-231-3
HS code
291450
Category
Aldehydes and ketones

What is 4-Isopropoxycyclohexanone?

Plain description, key identifiers and synonyms

4-Isopropoxycyclohexanone is a chemical substance with the molecular formula C9H16O2 and a molar mass of 156.23 g/mol. Its CAS registry number is 69697-46-7. The IUPAC name is 4-propan-2-yloxycyclohexan-1-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-propan-2-yloxycyclohexan-1-one
CAS number
69697-46-7 CAS number cross-checked
EC number
807-231-3
Molecular formula
C9H16O2
MDL number
MFCD16658578
InChIKey
QVHMVEHDBXFYCA-UHFFFAOYSA-N
InChI
InChI=1S/C9H16O2/c1-7(2)11-9-5-3-8(10)4-6-9/h7,9H,3-6H2,1-2H3
SMILES (canonical and isomeric)
CC(C)OC1CCC(=O)CC1

Synonyms

  • 4-(propan-2-yloxy)cyclohexan-1-one
  • 4-propan-2-yloxycyclohexan-1-one
  • 4-isopropoxy-cyclohexanone
  • 4-[(1-Methylethyl)oxy]cyclohexanone
  • 4-[(Propan-2-yl)oxy]cyclohexan-1-one

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
156.23 g/molcalc.
Exact mass
156.115 Dacalc.
LogP (octanol/water)
1.92calc.
Topological polar surface area
26.3 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
2calc.
Heavy atoms
11calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.89calc.
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=C1CCCCC1

O=C1CCCCC1

1 ring, 7 atoms, the Cyclohexanone ring system.

2,698 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302Harmful if swallowed.
  • H312Harmful in contact with skin.
  • H332Harmful if inhaled.
Precautionary statements (13)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P270Do not eat, drink or smoke when using this product.
  • P271Use only outdoors or in a well-ventilated area.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P317If swallowed: Get medical help.
  • P302 + P352If on skin: Wash with plenty of water.
  • P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
  • P317Get medical help.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P330Rinse mouth.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P501Dispose of contents and container in accordance with local regulations.

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

Full safety data and first aid

4-Isopropoxycyclohexanone suppliers

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4-Isopropoxycyclohexanone 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-Isopropoxycyclohexanone is traded under.

HS 2914.50Indicative HS code

Ketone-phenols and ketones with other oxygen function

World exports in 2024
$438M
+10.9% vs 2023, imports $420M
2019 to 2024
Top exporters
  1. China50.5%
  2. India * partner reported11.6%
  3. United States11.3%
Top importers
  1. United States20.8%
  2. Germany10.0%
  3. Netherlands8.6%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is 4-Isopropoxycyclohexanone?

4-Isopropoxycyclohexanone is a chemical substance with the molecular formula C9H16O2 and a molar mass of 156.23 g/mol. Its CAS registry number is 69697-46-7. The IUPAC name is 4-propan-2-yloxycyclohexan-1-one.

What is the CAS number of 4-Isopropoxycyclohexanone?

The CAS registry number of 4-Isopropoxycyclohexanone is 69697-46-7.

What is the molecular formula and weight of 4-Isopropoxycyclohexanone?

The molecular formula of 4-Isopropoxycyclohexanone is C9H16O2 and its molar mass is 156.23 g/mol.

What is 4-Isopropoxycyclohexanone used for?

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

Is 4-Isopropoxycyclohexanone hazardous?

4-Isopropoxycyclohexanone carries the GHS signal word "Warning". Main hazards: harmful if swallowed, harmful in contact with skin, harmful if inhaled. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of 4-Isopropoxycyclohexanone?

4-Isopropoxycyclohexanone is usually classified under HS code 291450 (Ketone-phenols and ketones with other oxygen function). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 4-Isopropoxycyclohexanone?

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What is the price of 4-Isopropoxycyclohexanone?

Suppliers quote 4-Isopropoxycyclohexanone 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-Isopropoxycyclohexanone

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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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