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Aromatic building blocks

Elemicin

Also known as 5-Allyl-1,2,3-trimethoxybenzene, 3,4,5-Trimethoxyallylbenzene, 1,2,3-trimethoxy-5-prop-2-enylbenzene

CAS 487-11-6Formula C12H16O3Molar mass 208.26 g/molEC 207-649-0
GHS signal word: Warning. Pictograms: Harmful or irritant 6 suppliers listed
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Elemicin chemical structure, C12H16O3, CAS 487-11-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
487-11-6
Formula
C12H16O3
Molar mass
208.26 g/mol
EC number
207-649-0
HS code
290930
Category
Aromatic building blocks

What is Elemicin?

Plain description, key identifiers and synonyms

Elemicin is an olefinic compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1,2,3-trimethoxy-5-prop-2-enylbenzene
CAS number
487-11-6 CAS number cross-checked
EC number
207-649-0
Molecular formula
C12H16O3
UNII
HSZ191AKAN
MDL number
MFCD01656688
InChIKey
BPLQKQKXWHCZSS-UHFFFAOYSA-N
InChI
InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5,7-8H,1,6H2,2-4H3
SMILES (canonical and isomeric)
COC1=CC(=CC(=C1OC)OC)CC=C

Synonyms

  • 5-Allyl-1,2,3-trimethoxybenzene
  • 3,4,5-Trimethoxyallylbenzene
  • 1,2,3-trimethoxy-5-prop-2-enylbenzene
  • Benzene, 1,2,3-trimethoxy-5-(2-propenyl)-
  • 1,2,3-Trimethoxy-5-(2-propenyl)benzene
  • 1,2,3-trimethoxy-5-(prop-2-en-1-yl)benzene
  • Benzene, 5-allyl-1,2,3-trimethoxy-
  • 3,4,5-trimethoxyallyl benzene
  • Benzene, 1,2,3-trimethoxy-5-(2-propen-1-yl)-
  • 4-methoxy-6-prop-2-enyl-1,3-benzodioxole
  • Elemicine
  • 3-(3,4,5-Trimethoxyphenyl)-1-propene
  • 4-allyl-1,2,6-trimethoxybenzene
  • 1,2,3-Trimethoxy-5-(2-propenyl)-benzene
  • 1,2,3-Trimethoxy-5-(2-propen-1-yl)benzene
  • Benzene, 5-(2-propenyl)-1,2,3-trimethoxy
  • 1-(3,4,5-Trimethoxyphenyl)-2-propene
  • 1,2,3-Trimethoxy-5-[2-propenyl]-benzene
  • 1,2,3-Trimethoxy-5-allylbenzene
  • 5-allyl-1,2,3-trimethoxy-benzene
  • 3,5-Trimethoxyallylbenzene
  • 5-(Prop-2-en-1-yl)-1,2,3-trimethoxybenzene
  • 4-06-00-07478 (Beilstein Handbook Reference)
  • 3,4, 5-Trimethoxyallylbenzene
  • 1-Allyl-3,4,5-trimethoxybenzene
Show all 31 synonyms
  • Benzene,2,3-trimethoxy-5-(2-propenyl)-
  • 1,2,3-Trimethoxy-5-allylbenzene (elemicin)
  • 1,2,3-Trimethoxy-5-(2-propen-1-yl)-benzene
  • 1,2,3-Trimethoxy-5-(2-propenyl)benzene, 9CI
  • 5-(Prop-2-enyl)-1,2,3-trimethoxybenzene
  • Benzene, 1,2,3-trimethoxy-5-(2-propenyl)- (9CI)

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
208.26 g/molcalc.
Exact mass
208.1099 Dacalc.
LogP (octanol/water)
2.44calc.
Topological polar surface area
27.69 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
5calc.
Heavy atoms
15calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.33calc.
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

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H317May cause an allergic skin reaction.
  • H319Causes serious eye irritation.
Precautionary statements (11)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P272Contaminated work clothing should not be allowed out of the workplace.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P302 + P352If on skin: Wash with plenty of water.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P333 + P317If skin irritation or rash occurs: Get medical help.
  • P337 + P317If eye irritation persists: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Elemicin suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

All 6 suppliers
6 of 6 offers
  • Chengdu Alfa Biotechnology Co., Ltd.
    China, Chengdu ManufacturerUnclaimed profile
    ElemicinGrade, purity and minimum order on request
    Price on request
    View
  • Kemcal
    United StatesUnclaimed profile
    ElemicinGrade, purity and minimum order on request
    Price on request
    View
  • H D D e S Extracts
    Sri Lanka, Colombo ManufacturerUnclaimed profile
    ElemicinGrade, purity and minimum order on request
    Price on request
    View
  • AvaChem Scientific LLC
    United StatesUnclaimed profile
    ElemicinGrade, purity and minimum order on request
    Price on request
    View
  • ChemFaces
    China, WuhanUnclaimed profile
    ElemicinGrade, purity and minimum order on request
    Price on request
    View
  • Rieke Metals, LLC
    United States, LincolnUnclaimed profile
    ElemicinGrade, purity and minimum order on request
    Price on request
    View

Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

6 suppliers in 3 countries

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Elemicin 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 Elemicin is traded under.

HS 2909.30Indicative HS code

Aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives

World exports in 2024
$470M
−2.2% vs 2023, imports $432M
2019 to 2024
Top exporters
  1. China45.7%
  2. Germany15.7%
  3. India * partner reported9.9%
Top importers
  1. United States14.3%
  2. China11.8%
  3. India * partner reported8.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Elemicin?

Elemicin is an olefinic compound.

What is the CAS number of Elemicin?

The CAS registry number of Elemicin is 487-11-6.

What is the molecular formula and weight of Elemicin?

The molecular formula of Elemicin is C12H16O3 and its molar mass is 208.26 g/mol.

What is Elemicin used for?

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

Is Elemicin hazardous?

Elemicin carries the GHS signal word "Warning". Main hazards: may cause an allergic skin reaction, causes serious eye irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Elemicin?

Elemicin is usually classified under HS code 290930 (Aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Elemicin?

CompoundList lists 6 suppliers of Elemicin in United States, China and Sri Lanka. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Elemicin?

Suppliers quote Elemicin 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 Elemicin

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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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