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massoialactone

CAS 16400-72-9C12H20O2MW 196.29

massoialactone (CAS 16400-72-9) — formula C12H20O2, molecular weight 196.29; category organic chemicals.

Product Overview

CAS Number16400-72-9
Molecular FormulaC12H20O2
Molecular Weight196.29
Boiling Point315.00 to 317.00 °C. @ 760.00 mm Hg
LogP4.2
ApplicationsUse Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 2H-Pyran-2-one, 6-heptyl-5, 6-dihydro-: ACTIVE
CategoryOrganic Chemicals

Applications

Documented applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 2H-Pyran-2-one, 6-heptyl-5, 6-dihydro-: ACTIVE.

Technical Profile

What this product is

massoialactone is a carbon-based organic compound with CAS registry number 16400-72-9 and molecular formula C12H20O2 (molecular weight 196.29), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 16400-72-9

Its molecular formula C12H20O2 comprises 12 C, 20 H, 2 O atoms.

Also known as: massoialactone · 马索内酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of massoialactone?

The CAS registry number of massoialactone is 16400-72-9.

What is the molecular formula and molecular weight of massoialactone?

Molecular formula C12H20O2, molecular weight 196.29.

What other names is massoialactone known by?

It is also registered under: massoialactone, 马索内酯.

What are the documented applications of massoialactone?

Recorded applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 2H-Pyran-2-one, 6-heptyl-5, 6-dihydro-: ACTIVE.

Which category does massoialactone belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for massoialactone (CAS 16400-72-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number16400-72-9
PubChem CID61834
Molecular formulaC12H20O2
IUPAC name2-heptyl-2,3-dihydropyran-6-one
UNII (FDA)407E8N1CFC
FEMA number3802
JECFA number438

Computed descriptors

Molecular Weight196.29
XLogP34.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass196.146329876
Monoisotopic Mass196.146329876
Topological Polar Surface Area26.3
Heavy Atom Count14

Physicochemical values on record

Boiling Point315.00 to 317.00 °C. @ 760.00 mm Hg
Boiling Point115 °C (2 mmHg)
Density1.470-1.480
Refractive Index1.467-1.473

Documented uses on record

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

    Synonyms and trade names

    6-Heptyl-5,6-dihydro-2H-pyran-2-one; 16400-72-9; 2-dodecen-5-olide; 2H-Pyran-2-one, 6-heptyl-5,6-dihydro-; delta-2-Dodecenolactone; 5-Hydroxy-2-dodecenoic acid lactone; 6-Heptyl-5,6-dihydropyran-2-one; UNII-407E8N1CFC; 5-Heptyl-2-pentene-5-olide; 407E8N1CFC; 5-Hydroxy-2-dodecenoic acid delta-lactone; 6-Heptyl-5,6-dihydro-2-pyrone; EINECS 240-453-3; FEMA NO. 3802; DTXSID50864674; 5-HYDROXY-2-DODECENOIC ACID LACTONE [FHFI]

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Dairy
    NOT EVALUATED
    GHS notification summary100% (89 / 89)

    GHS hazard classification

    GHS notification summary100% (89 / 89)

    This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.

    Reported as not meeting GHS hazard criteria by 89 of 89 companies. For more detailed information, please visit ECHA C&L website.

    What the public record says

    massoialactone · CAS 16400-72-9 · C12H20O2. UNII 407E8N1CFC. Boiling Point: 315.00 to 317.00 °C. @ 760.00 mm Hg; Boiling Point: 115 °C (2 mmHg); Density: 1.470-1.480.

    Physical description and handling notes

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

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