CompoundList

cis-4-Hydroxy-3-methyl-cyclohexanone

Also known as cis-4-Hydroxy-3-methylcyclohexan-1-one, (3R,4S)-4-hydroxy-3-methylcyclohexan-1-one

CAS 125074-37-5Formula C7H12O2Molar mass 128.17 g/mol
cis-4-Hydroxy-3-methyl-cyclohexanone chemical structure, C7H12O2, CAS 125074-37-5
2D chemical structure

Key facts

What buyers check first

CAS number
125074-37-5
Formula
C7H12O2
Molar mass
128.17 g/mol
HS code
291440
Category
Aldehydes and ketones

What is cis-4-Hydroxy-3-methyl-cyclohexanone?

Plain description, key identifiers and synonyms

cis-4-Hydroxy-3-methyl-cyclohexanone is a chemical substance with the molecular formula C7H12O2 and a molar mass of 128.17 g/mol. Its CAS registry number is 125074-37-5. The IUPAC name is cis-(3R,4S)-4-hydroxy-3-methylcyclohexan-1-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
cis-(3R,4S)-4-hydroxy-3-methylcyclohexan-1-one
CAS number
125074-37-5
Molecular formula
C7H12O2
InChIKey
BSSXPZSFKIABFR-VDTYLAMSSA-N
InChI
InChI=1S/C7H12O2/c1-5-4-6(8)2-3-7(5)9/h5,7,9H,2-4H2,1H3/t5-,7+/m1/s1
Canonical SMILES
CC1CC(=O)CCC1O
Isomeric SMILES
C[C@@H]1CC(=O)CC[C@@H]1O

Synonyms

  • cis-4-Hydroxy-3-methylcyclohexan-1-one
  • (3R,4S)-4-hydroxy-3-methylcyclohexan-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
128.17 g/molcalc.
Exact mass
128.0837 Dacalc.
LogP (octanol/water)
0.74calc.
Topological polar surface area
37.3 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
0calc.
Heavy atoms
9calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.86calc.
Formal charge
0calc.
Stereocentres
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=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

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.

cis-4-Hydroxy-3-methyl-cyclohexanone suppliers

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cis-4-Hydroxy-3-methyl-cyclohexanone price

Indicative price range per kg from live supplier offers

No published prices right now

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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 cis-4-Hydroxy-3-methyl-cyclohexanone is traded under.

HS 2914.40Indicative HS code

Ketone-alcohols and ketone-aldehydes

World exports in 2024
$199M
+2.5% vs 2023, imports $247M
2019 to 2024
Top exporters
  1. China29.5%
  2. Germany14.4%
  3. Netherlands12.7%
Top importers
  1. United States37.2%
  2. Netherlands8.5%
  3. Germany6.4%
Reported customs values in USD, not prices.Full trade data

The HS code shown for cis-4-Hydroxy-3-methyl-cyclohexanone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about cis-4-Hydroxy-3-methyl-cyclohexanone, based on the data on this page

What is cis-4-Hydroxy-3-methyl-cyclohexanone?

cis-4-Hydroxy-3-methyl-cyclohexanone is a chemical substance with the molecular formula C7H12O2 and a molar mass of 128.17 g/mol. Its CAS registry number is 125074-37-5. The IUPAC name is cis-(3R,4S)-4-hydroxy-3-methylcyclohexan-1-one.

What is the CAS number of cis-4-Hydroxy-3-methyl-cyclohexanone?

The CAS registry number of cis-4-Hydroxy-3-methyl-cyclohexanone is 125074-37-5.

What is the molecular formula and weight of cis-4-Hydroxy-3-methyl-cyclohexanone?

The molecular formula of cis-4-Hydroxy-3-methyl-cyclohexanone is C7H12O2 and its molar mass is 128.17 g/mol.

What is cis-4-Hydroxy-3-methyl-cyclohexanone used for?

Known uses and roles of cis-4-Hydroxy-3-methyl-cyclohexanone include building blocks in research and laboratory and screening compounds in research and laboratory.

Is cis-4-Hydroxy-3-methyl-cyclohexanone hazardous?

No GHS hazard classification for cis-4-Hydroxy-3-methyl-cyclohexanone 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 cis-4-Hydroxy-3-methyl-cyclohexanone?

cis-4-Hydroxy-3-methyl-cyclohexanone is usually classified under HS code 291440 (Ketone-alcohols and ketone-aldehydes). This is indicative, confirm it with your customs broker before shipping.

Where can I buy cis-4-Hydroxy-3-methyl-cyclohexanone?

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What is the price of cis-4-Hydroxy-3-methyl-cyclohexanone?

Suppliers quote cis-4-Hydroxy-3-methyl-cyclohexanone 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 cis-4-Hydroxy-3-methyl-cyclohexanone

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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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