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Aromatic building blocks

Sorbophenone, E,E-

CAS 57309-79-2Formula C13H14O3Molar mass 218.25 g/mol
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Sorbophenone, E,E- chemical structure, C13H14O3, CAS 57309-79-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
57309-79-2
Formula
C13H14O3
Molar mass
218.25 g/mol
HS code
291450
Category
Aromatic building blocks

What is Sorbophenone, E,E-?

Plain description, key identifiers and synonyms

Sorbophenone, E,E- is a chemical substance with the molecular formula C13H14O3 and a molar mass of 218.25 g/mol. Its CAS registry number is 57309-79-2. The IUPAC name is (2E,4E)-1-(2-hydroxy-4-methoxyphenyl)hexa-2,4-dien-1-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2E,4E)-1-(2-hydroxy-4-methoxyphenyl)hexa-2,4-dien-1-one
CAS number
57309-79-2
Molecular formula
C13H14O3
InChIKey
NWVHMNPNVNFNFQ-VNKDHWASSA-N
InChI
InChI=1S/C13H14O3/c1-3-4-5-6-12(14)11-8-7-10(16-2)9-13(11)15/h3-9,15H,1-2H3/b4-3+,6-5+
Canonical SMILES
CC=CC=CC(=O)c1ccc(OC)cc1O
Isomeric SMILES
C/C=C/C=C/C(=O)C1=C(C=C(C=C1)OC)O

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
218.25 g/molcalc.
Exact mass
218.0943 Dacalc.
LogP (octanol/water)
2.72calc.
Topological polar surface area
46.53 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
4calc.
Heavy atoms
16calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.15calc.
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, 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.

Sorbophenone, E,E- suppliers

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Sorbophenone, E,E- price

Indicative price range per kg from live supplier offers

No published prices right now

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

Frequently asked questions

Quick answers about Sorbophenone, E,E-, based on the data on this page

What is Sorbophenone, E,E-?

Sorbophenone, E,E- is a chemical substance with the molecular formula C13H14O3 and a molar mass of 218.25 g/mol. Its CAS registry number is 57309-79-2. The IUPAC name is (2E,4E)-1-(2-hydroxy-4-methoxyphenyl)hexa-2,4-dien-1-one.

What is the CAS number of Sorbophenone, E,E-?

The CAS registry number of Sorbophenone, E,E- is 57309-79-2.

What is the molecular formula and weight of Sorbophenone, E,E-?

The molecular formula of Sorbophenone, E,E- is C13H14O3 and its molar mass is 218.25 g/mol.

What is Sorbophenone, E,E- used for?

Known uses and roles of Sorbophenone, E,E- include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Sorbophenone, E,E- hazardous?

No GHS hazard classification for Sorbophenone, E,E- 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 Sorbophenone, E,E-?

Sorbophenone, E,E- 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 Sorbophenone, E,E-?

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

What is the price of Sorbophenone, E,E-?

Suppliers quote Sorbophenone, E,E- 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 Sorbophenone, E,E-

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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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