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Aromatic building blocks

Ardisin

Also known as 2-methyl-5-[(Z)-tridec-8-enyl]benzene-1,3-diol, 1,3-Benzenediol, 2-methyl-5-(8-tridecenyl)-, (Z)-

CAS 72629-62-0Formula C20H32O2Molar mass 304.47 g/mol
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Ardisin chemical structure, C20H32O2, CAS 72629-62-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
72629-62-0
Formula
C20H32O2
Molar mass
304.47 g/mol
HS code
290729
Category
Aromatic building blocks

What is Ardisin?

Plain description, key identifiers and synonyms

2-methyl-5-[(Z)-tridec-8-enyl]benzene-1,3-diol has been reported in Ardisia compressa.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-methyl-5-[(Z)-tridec-8-enyl]benzene-1,3-diol
CAS number
72629-62-0
Molecular formula
C20H32O2
InChIKey
AAFWHAONVYRTMW-SREVYHEPSA-N
InChI
InChI=1S/C20H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-15-19(21)17(2)20(22)16-18/h6-7,15-16,21-22H,3-5,8-14H2,1-2H3/b7-6-
Canonical SMILES
CCCCC=CCCCCCCCc1cc(O)c(C)c(O)c1
Isomeric SMILES
CCCC/C=C\CCCCCCCC1=CC(=C(C(=C1)O)C)O

Synonyms

  • 2-methyl-5-[(Z)-tridec-8-enyl]benzene-1,3-diol
  • 1,3-Benzenediol, 2-methyl-5-(8-tridecenyl)-, (Z)-

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
304.47 g/molcalc.
Exact mass
304.2402 Dacalc.
LogP (octanol/water)
6.04calc.
Topological polar surface area
40.46 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
11calc.
Heavy atoms
22calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.6calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (1 violation)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 Benzene ring system.

485,677 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.

Ardisin suppliers

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Ardisin 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

Pharmacological actions

  • Topoisomerase II Inhibitors

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 Ardisin is traded under.

HS 2907.29Indicative HS code

Polyphenols, phenol-alcohols, other

World exports in 2024
$535M
−27.0% vs 2023, imports $565M
2019 to 2024
Top exporters
  1. India * partner reported17.7%
  2. Germany16.5%
  3. Japan15.8%
Top importers
  1. United States13.1%
  2. Japan8.0%
  3. Belgium7.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Ardisin?

2-methyl-5-[(Z)-tridec-8-enyl]benzene-1,3-diol has been reported in Ardisia compressa.

What is the CAS number of Ardisin?

The CAS registry number of Ardisin is 72629-62-0.

What is the molecular formula and weight of Ardisin?

The molecular formula of Ardisin is C20H32O2 and its molar mass is 304.47 g/mol.

What is Ardisin used for?

Known uses and roles of Ardisin include building blocks in research and laboratory and topoisomerase ii inhibitors.

Is Ardisin hazardous?

No GHS hazard classification for Ardisin 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 Ardisin?

Ardisin is usually classified under HS code 290729 (Polyphenols, phenol-alcohols, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Ardisin?

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

What is the price of Ardisin?

Suppliers quote Ardisin 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 Ardisin

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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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