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Home › Product Catalog › 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran

4,5,6,7-tetrahydro-3,6-dimethylbenzofuran

CAS 494-90-6C10H14OMW 150.10 g/mol

4,5,6,7-tetrahydro-3,6-dimethylbenzofuran (CAS 494-90-6) — formula C10H14O, molecular weight 150.10 g/mol; category organic chemicals.

Product Overview

CAS Number494-90-6
Molecular FormulaC10H14O
Molecular Weight150.10 g/mol
Melting Point86.00 °C. @ 760.00 mm Hg
Boiling Point80.00 to 82.00 °C. @ 13.00 mm Hg
LogP3
ApplicationsUse Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Benzofuran, 4, 5, 6, 7-tetrahydro-3, 6-dimethyl-: ACTIVE
CategoryOrganic Chemicals

Applications

Documented applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Benzofuran, 4, 5, 6, 7-tetrahydro-3, 6-dimethyl-: ACTIVE.

Technical Profile

What this product is

4,5,6,7-tetrahydro-3,6-dimethylbenzofuran is a carbon-based organic compound with CAS registry number 494-90-6 and molecular formula C10H14O (molecular weight 150.10 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 494-90-6

Its molecular formula C10H14O comprises 10 C, 14 H, 1 O atoms.

Also known as: 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran · 薄荷呋喃

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran?

The CAS registry number of 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran is 494-90-6.

What is the molecular formula and molecular weight of 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran?

Molecular formula C10H14O, molecular weight 150.10 g/mol.

What other names is 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran known by?

It is also registered under: 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran, 薄荷呋喃.

What are the documented applications of 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran?

Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Benzofuran, 4, 5, 6, 7-tetrahydro-3, 6-dimethyl-: ACTIVE.

Which category does 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 4,5,6,7-tetrahydro-3,6-dimethylbenzofuran (CAS 494-90-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number494-90-6
PubChem CID329983
Molecular formulaC10H14O
Molecular weight150.10 g/mol
IUPAC name3,6-dimethyl-4,5,6,7-tetrahydro-1-benzofuran
InChIKeyYGWKXXYGDYYFJU-UHFFFAOYSA-N
UNII (FDA)LK024V9U3C
ChEBI IDCHEBI:50542
FEMA number3235
JECFA number758

Computed descriptors

Molecular Weight150.22
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass150.104465066
Monoisotopic Mass150.104465066
Topological Polar Surface Area13.1
Heavy Atom Count11

Physicochemical values on record

Boiling Point80.00 to 82.00 °C. @ 13.00 mm Hg
Boiling Point196 °C; 95 °C (20 mm Hg); 80 °C (18 mm Hg); 90-92 °C (3 mm Hg)
Melting Point86.00 °C. @ 760.00 mm Hg
Density0.960-0.970
Refractive Index1.481-1.486

Documented uses on record

    Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional ClassesFlavoring Agents -> JECFA Flavorings Index

    Synonyms and trade names

    Menthofuran; 494-90-6; 3,6-Dimethyl-4,5,6,7-tetrahydro-1-benzofuran; 3,9-Epoxy-p-mentha-3,8-diene; BENZOFURAN, 4,5,6,7-TETRAHYDRO-3,6-DIMETHYL-; p-Mentha-3,8-diene, 3,9-epoxy-; DTXSID9025534; FEMA No. 3235; 4,5,6,7-Tetrahydro-3,6-dimethylcoumarone; LK024V9U3C; DTXCID005534; CHEBI:50542; RefChem:156491; Menthofurane; 3,6-dimethyl-4,5,6,7-tetrahydrobenzofuran; 4,5,6,7-Tetrahydro-3,6-dimethylbenzofuran

    Regulatory listings held on file

    Regulatory & Food ContactFDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    FLAVOURING_AGENT: Flavouring Agent
    Flavoring Agents
    Savory
    No safety concern at current levels of intake when used as a flavouring agent
    TRS 901-JECFA 55/56
    GHS notification summary0.1% (1 / 1646)

    GHS hazard classification

    GHS notification summary0.1% (1 / 1646)
    Reported hazard statementsH302, H315, H319 (99.6%), H411, H301, H351, H372

    This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1646) of reports.

    H302 (> 99.9%): Harmful if swallowed [Warning Acute toxicity, oral]

    What the public record says

    4,5,6,7-tetrahydro-3,6-dimethylbenzofuran is identified by CAS 494-90-6, molecular formula C10H14O and molecular weight 150.10 g/mol. UNII LK024V9U3C; ChEBI 50542; InChIKey YGWKXXYGDYYFJU-UHFFFAOYSA-N. Boiling Point: 80.00 to 82.00 °C. @ 13.00 mm Hg; Boiling Point: 196 °C; 95 °C (20 mm Hg); 80 °C (18 mm Hg); 90-92 °C (3 mm Hg); Melting Point: 86.00 °C. @ 760.00 mm Hg.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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