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Aromatic building blocks

Isoferulaldehyde

Also known as 3-(3-hydroxy-4-methoxyphenyl)prop-2-enal, (E)-3-(3-Hydroxy-4-methoxyphenyl)acrylaldehyde, 3-hydroxy-4-methoxycinnamaladehyde

CAS 110037-35-9Formula C10H10O3Molar mass 178.19 g/mol
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Isoferulaldehyde chemical structure, C10H10O3, CAS 110037-35-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
110037-35-9
Formula
C10H10O3
Molar mass
178.19 g/mol
HS code
291249
Category
Aromatic building blocks

What is Isoferulaldehyde?

Plain description, key identifiers and synonyms

(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enal has been reported in Tarenna attenuata, Flemingia paniculata, and other organisms.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enal
CAS number
110037-35-9Other or deprecated CAS: 333754-86-2
Molecular formula
C10H10O3
InChIKey
LBRCSWZZLJVBKB-NSCUHMNNSA-N
InChI
InChI=1S/C10H10O3/c1-13-10-5-4-8(3-2-6-11)7-9(10)12/h2-7,12H,1H3/b3-2+
Canonical SMILES
COc1ccc(C=CC=O)cc1O
Isomeric SMILES
COC1=C(C=C(C=C1)/C=C/C=O)O

Synonyms

  • 3-(3-hydroxy-4-methoxyphenyl)prop-2-enal
  • (E)-3-(3-Hydroxy-4-methoxyphenyl)acrylaldehyde
  • 3-hydroxy-4-methoxycinnamaladehyde

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
178.19 g/molcalc.
Exact mass
178.063 Dacalc.
LogP (octanol/water)
1.61calc.
Topological polar surface area
46.53 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
3calc.
Heavy atoms
13calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.1calc.
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.

Isoferulaldehyde suppliers

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Isoferulaldehyde 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 Isoferulaldehyde is traded under.

HS 2912.49Indicative HS code

Aldehyde-alcohols, aldehyde-ethers, aldehyde-phenols and aldehydes with other oxygen…

World exports in 2024
$159M
−9.6% vs 2023, imports $171M
2019 to 2024
Top exporters
  1. China36.7%
  2. India * partner reported27.5%
  3. Germany13.9%
Top importers
  1. China16.0%
  2. United States15.7%
  3. India * partner reported9.6%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Isoferulaldehyde?

(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enal has been reported in Tarenna attenuata, Flemingia paniculata, and other organisms.

What is the CAS number of Isoferulaldehyde?

The CAS registry number of Isoferulaldehyde is 110037-35-9. Other or deprecated CAS numbers: 333754-86-2.

What is the molecular formula and weight of Isoferulaldehyde?

The molecular formula of Isoferulaldehyde is C10H10O3 and its molar mass is 178.19 g/mol.

What is Isoferulaldehyde used for?

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

Is Isoferulaldehyde hazardous?

No GHS hazard classification for Isoferulaldehyde 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 Isoferulaldehyde?

Isoferulaldehyde is usually classified under HS code 291249 (Aldehyde-alcohols, aldehyde-ethers, aldehyde-phenols and aldehydes with other oxygen…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Isoferulaldehyde?

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

What is the price of Isoferulaldehyde?

Suppliers quote Isoferulaldehyde 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 Isoferulaldehyde

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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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