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Aldehydes and ketones

Odoratol

Also known as 2-hydroxy-1-(2-hydroxy-4-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one, alpha,2'-dihydroxy-4,4'-dimethoxydihydrochalcone

CAS 94943-12-1Formula C17H18O5Molar mass 302.33 g/mol
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Odoratol chemical structure, C17H18O5, CAS 94943-12-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
94943-12-1
Formula
C17H18O5
Molar mass
302.33 g/mol
HS code
291450
Category
Aldehydes and ketones

What is Odoratol?

Plain description, key identifiers and synonyms

Odoratol is a member of the class of dihydrochalcones that is dihydrochalcone substituted by a hydroxy group at position 2', methoxy groups at positions 4 and 4' and a hydroxy group at position alpha- to the ketonic group. It has a role as a plant metabolite. It is a diol, a secondary alpha-hydroxy ketone, a monomethoxybenzene, a member of phenols and a member of dihydrochalcones.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-hydroxy-1-(2-hydroxy-4-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one
CAS number
94943-12-1 CAS number cross-checked
Molecular formula
C17H18O5
InChIKey
PPOABILDHKLUET-UHFFFAOYSA-N
InChI
InChI=1S/C17H18O5/c1-21-12-5-3-11(4-6-12)9-16(19)17(20)14-8-7-13(22-2)10-15(14)18/h3-8,10,16,18-19H,9H2,1-2H3
SMILES (canonical and isomeric)
COC1=CC=C(C=C1)CC(C(=O)C2=C(C=C(C=C2)OC)O)O

Synonyms

  • 2-hydroxy-1-(2-hydroxy-4-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one
  • alpha,2'-dihydroxy-4,4'-dimethoxydihydrochalcone

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
302.33 g/molcalc.
Exact mass
302.1154 Dacalc.
LogP (octanol/water)
2.2calc.
Topological polar surface area
75.99 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
6calc.
Heavy atoms
22calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.24calc.
Formal charge
0calc.
Stereocentres
1calc.
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=C(CCc1ccccc1)c1ccccc1

O=C(CCc1ccccc1)c1ccccc1

2 rings, 16 atoms, the Dihydrochalcone ring system.

1,867 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.

Odoratol suppliers

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Odoratol 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

Roles

  • eukaryotic metabolite
  • metabolite
  • plant metabolite

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

Frequently asked questions

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

What is Odoratol?

Odoratol is a member of the class of dihydrochalcones that is dihydrochalcone substituted by a hydroxy group at position 2', methoxy groups at positions 4 and 4' and a hydroxy group at position alpha- to the ketonic group. It has a role as a plant metabolite.

What is the CAS number of Odoratol?

The CAS registry number of Odoratol is 94943-12-1.

What is the molecular formula and weight of Odoratol?

The molecular formula of Odoratol is C17H18O5 and its molar mass is 302.33 g/mol.

What is Odoratol used for?

Known uses and roles of Odoratol include eukaryotic metabolite, metabolite and plant metabolite.

Is Odoratol hazardous?

No GHS hazard classification for Odoratol 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 Odoratol?

Odoratol 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 Odoratol?

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

What is the price of Odoratol?

Suppliers quote Odoratol 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 Odoratol

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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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