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Aromatic building blocks

Arucadiol

Also known as Miltiodiol, 5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3-dihydrophenanthren-4-one, 5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-2,3-dihydrophenanthren-4(1H)-one

CAS 105037-85-2Formula C19H22O3Molar mass 298.38 g/mol
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Arucadiol chemical structure, C19H22O3, CAS 105037-85-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
105037-85-2
Formula
C19H22O3
Molar mass
298.38 g/mol
HS code
291450
Category
Aromatic building blocks

What is Arucadiol?

Plain description, key identifiers and synonyms

Arucadiol has been reported in Salvia miltiorrhiza, Salvia officinalis, and other organisms.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3-dihydrophenanthren-4-one
CAS number
105037-85-2
Molecular formula
C19H22O3
InChIKey
CEIJAQIIDANFLF-UHFFFAOYSA-N
InChI
InChI=1S/C19H22O3/c1-10(2)12-9-11-5-6-13-16(15(11)18(22)17(12)21)14(20)7-8-19(13,3)4/h5-6,9-10,21-22H,7-8H2,1-4H3
SMILES (canonical and isomeric)
CC(C)C1=C(C(=C2C(=C1)C=CC3=C2C(=O)CCC3(C)C)O)O

Synonyms

  • Miltiodiol
  • 5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3-dihydrophenanthren-4-one
  • 5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-2,3-dihydrophenanthren-4(1H)-one
  • 5,6-dihydroxy-7-isopropyl-1,1-dimethyl-2,3-dihydrophenanthren-4-one
  • 5,6-Dihydroxy-1,1-dimethyl-7-(propan-2-yl)-2,3-dihydrophenanthren-4(1H)-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
298.38 g/molcalc.
Exact mass
298.1569 Dacalc.
LogP (octanol/water)
4.63calc.
Topological polar surface area
57.53 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
1calc.
Heavy atoms
22calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.42calc.
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=C1CCCc2ccc3ccccc3c21

O=C1CCCc2ccc3ccccc3c21

3 rings, 15 atoms, the 2,3-Dihydro-1H-phenanthren-4-one ring system.

13 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.

Arucadiol suppliers

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

Frequently asked questions

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

What is Arucadiol?

Arucadiol has been reported in Salvia miltiorrhiza, Salvia officinalis, and other organisms.

What is the CAS number of Arucadiol?

The CAS registry number of Arucadiol is 105037-85-2.

What is the molecular formula and weight of Arucadiol?

The molecular formula of Arucadiol is C19H22O3 and its molar mass is 298.38 g/mol.

What is Arucadiol used for?

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

Is Arucadiol hazardous?

No GHS hazard classification for Arucadiol 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 Arucadiol?

Arucadiol 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 Arucadiol?

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

What is the price of Arucadiol?

Suppliers quote Arucadiol 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 Arucadiol

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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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