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Aliphatic and alicyclic building blocks

Jacaranone

Also known as methyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate, 1-Hydroxy-4-oxo-2,5-cyclohexadiene-1-acetic acid methyl ester, Jacaramome

CAS 60263-07-2Formula C9H10O4Molar mass 182.18 g/mol
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Jacaranone chemical structure, C9H10O4, CAS 60263-07-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
60263-07-2
Formula
C9H10O4
Molar mass
182.18 g/mol
HS code
291899
Category
Aliphatic and alicyclic building blocks

What is Jacaranone?

Plain description, key identifiers and synonyms

Jacaranone is a chemical substance with the molecular formula C9H10O4 and a molar mass of 182.18 g/mol. Its CAS registry number is 60263-07-2. The IUPAC name is methyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate
CAS number
60263-07-2 CAS number cross-checked
Molecular formula
C9H10O4
MDL number
MFCD17167002
InChIKey
WJZSKNRPRWCLLK-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O4/c1-13-8(11)6-9(12)4-2-7(10)3-5-9/h2-5,12H,6H2,1H3
SMILES (canonical and isomeric)
COC(=O)CC1(C=CC(=O)C=C1)O

Synonyms

  • methyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate
  • 1-Hydroxy-4-oxo-2,5-cyclohexadiene-1-acetic acid methyl ester
  • Jacaramome
  • methyl 2-(1-hydroxy-4-oxo-cyclohexa-2,5-dien-1-yl)acetate
  • Wjzsknrprwcllk-uhfffaoysa-
  • methyl (1-hydroxy-4-oxo-2,5-cyclohexandienyl)acetate
  • Methyl (1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate
  • 2,5-Cyclohexadiene-1-acetic acid, 1-hydroxy-4-oxo-, methyl ester

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
182.18 g/molcalc.
Exact mass
182.0579 Dacalc.
LogP (octanol/water)
-0.02calc.
Topological polar surface area
63.6 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
2calc.
Heavy atoms
13calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.33calc.
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=C1C=CCC=C1

O=C1C=CCC=C1

1 ring, 7 atoms, the 2,5-Cyclohexadienone ring system.

298 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.

Jacaranone suppliers

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Jacaranone price

Indicative price range per kg from live supplier offers

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Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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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 Jacaranone is traded under.

HS 2918.99Indicative HS code

Carboxylic acids, with additional oxygen function (not alcohol, phenol, aldehyde or ketone)…

World exports in 2024
$1.46B
−1.1% vs 2023, imports $1.54B
2019 to 2024
Top exporters
  1. China40.0%
  2. India * partner reported26.6%
  3. Germany8.0%
Top importers
  1. United States25.6%
  2. Brazil6.7%
  3. Argentina5.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Jacaranone?

Jacaranone is a chemical substance with the molecular formula C9H10O4 and a molar mass of 182.18 g/mol. Its CAS registry number is 60263-07-2. The IUPAC name is methyl 2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetate.

What is the CAS number of Jacaranone?

The CAS registry number of Jacaranone is 60263-07-2.

What is the molecular formula and weight of Jacaranone?

The molecular formula of Jacaranone is C9H10O4 and its molar mass is 182.18 g/mol.

What is Jacaranone used for?

Known uses and roles of Jacaranone include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Jacaranone hazardous?

No GHS hazard classification for Jacaranone 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 Jacaranone?

Jacaranone is usually classified under HS code 291899 (Carboxylic acids with additional oxygen function and their anhydrides, halides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Jacaranone?

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

What is the price of Jacaranone?

Suppliers quote Jacaranone 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 Jacaranone

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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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