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Aromatic building blocks

Yerrinquinone

Also known as methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxonaphthalene-2-carboxylate, Methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxo-5,8-dihydronaphthalene-2-carboxylic acid, Methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxo-5,8-dihydro-2-naphthalenecarboxylate #

CAS 129308-67-4Formula C14H12O7Molar mass 292.24 g/mol
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Yerrinquinone chemical structure, C14H12O7, CAS 129308-67-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
129308-67-4
Formula
C14H12O7
Molar mass
292.24 g/mol
HS code
291899
Category
Aromatic building blocks

What is Yerrinquinone?

Plain description, key identifiers and synonyms

Yerrinquinone has been reported in Diospyros montana.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxonaphthalene-2-carboxylate
CAS number
129308-67-4
Molecular formula
C14H12O7
InChIKey
IQNNCIUGIWEXCC-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O7/c1-19-9-5-8(16)11-10(12(9)17)7(15)4-6(13(11)20-2)14(18)21-3/h4-5,15H,1-3H3
SMILES (canonical and isomeric)
COC1=CC(=O)C2=C(C(=CC(=C2C1=O)O)C(=O)OC)OC

Synonyms

  • methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxonaphthalene-2-carboxylate
  • Methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxo-5,8-dihydronaphthalene-2-carboxylic acid
  • Methyl 4-hydroxy-1,6-dimethoxy-5,8-dioxo-5,8-dihydro-2-naphthalenecarboxylate #

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
292.24 g/molcalc.
Exact mass
292.0583 Dacalc.
LogP (octanol/water)
1.1calc.
Topological polar surface area
99.13 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
3calc.
Heavy atoms
21calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.21calc.
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=CC(=O)c2ccccc21

O=C1C=CC(=O)c2ccccc21

2 rings, 12 atoms, the 1,4-Naphthoquinone ring system.

875 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.

Yerrinquinone suppliers

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Yerrinquinone 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 Yerrinquinone 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 Yerrinquinone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

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

What is Yerrinquinone?

Yerrinquinone has been reported in Diospyros montana.

What is the CAS number of Yerrinquinone?

The CAS registry number of Yerrinquinone is 129308-67-4.

What is the molecular formula and weight of Yerrinquinone?

The molecular formula of Yerrinquinone is C14H12O7 and its molar mass is 292.24 g/mol.

What is Yerrinquinone used for?

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

Is Yerrinquinone hazardous?

No GHS hazard classification for Yerrinquinone 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 Yerrinquinone?

Yerrinquinone 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 Yerrinquinone?

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

What is the price of Yerrinquinone?

Suppliers quote Yerrinquinone 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 Yerrinquinone

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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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