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whisky lactone

CAS 39212-23-2C9H16O2MW 156.22

whisky lactone (CAS 39212-23-2) — formula C9H16O2, molecular weight 156.22; category organic chemicals.

Product Description

whisky lactone (CAS 39212-23-2) is a chemical raw material in the organic chemicals category. Its molecular formula C9H16O2 comprises 9 C, 16 H, 2 O atoms. Its molecular weight is about 156.22. Reported physicochemical data: boiling point around 93-94 °C, LogP about 2.5. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.

Product Overview

CAS Number39212-23-2
Molecular FormulaC9H16O2
Molecular Weight156.22
Boiling Point93-94 °C
LogP2.5
ApplicationsFragrance Ingredients, Flavoring Agents, Flavouring Agent, Household Products: Information on 3 consumer products that contain 3-Methyl-Gamma-Octalactone in the following categories is provided, • Auto Products, • Inside the Home
CategoryOrganic Chemicals

Applications

Documented applications: Fragrance Ingredients, Flavoring Agents, Flavouring Agent, Household Products: Information on 3 consumer products that contain 3-Methyl-Gamma-Octalactone in the following categories is provided, • Auto Products, • Inside the Home.

Technical Profile

What this product is

whisky lactone is a carbon-based organic compound with CAS registry number 39212-23-2 and molecular formula C9H16O2 (molecular weight 156.22), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 39212-23-2

Its molecular formula C9H16O2 comprises 9 C, 16 H, 2 O atoms.

Also known as: whisky lactone · 威士忌内酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of whisky lactone?

The CAS registry number of whisky lactone is 39212-23-2.

What is the molecular formula and molecular weight of whisky lactone?

Molecular formula C9H16O2, molecular weight 156.22.

What other names is whisky lactone known by?

It is also registered under: whisky lactone, 威士忌内酯.

What are the documented applications of whisky lactone?

Recorded applications: Fragrance Ingredients, Flavoring Agents, Flavouring Agent, Household Products: Information on 3 consumer products that contain 3-Methyl-Gamma-Octalactone in the following categories is provided, • Auto Products, • Inside the Home.

Which category does whisky lactone belong to?

Category: Organic Chemicals.

Packaging & documentation

Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.

PubChem Public Data

Independent reference data for whisky lactone (CAS 39212-23-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number39212-23-2
PubChem CID62900
Molecular formulaC9H16O2
IUPAC name5-butyl-4-methyloxolan-2-one
UNII (FDA)HKX8Y5BUAO
FEMA number3803
JECFA number437

Computed descriptors

Molecular Weight156.22
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass156.115029749
Monoisotopic Mass156.115029749
Topological Polar Surface Area26.3
Heavy Atom Count11

Physicochemical values on record

Boiling Point93-94 °C
Density1.442-1.446
Refractive Index0.952

Documented uses on record

    Flavoring Agents -> JECFA Flavorings IndexFlavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

    Synonyms and trade names

    Oaklactone; 3-Methyl-4-octanolide; beta-Methyl-gamma-octalactone; 4-Hydroxy-3-methyloctanoic acid lactone; FEMA No. 3803; 5-Butyl-4-methyldihydro-2(3H)-furanone; HKX8Y5BUAO; RefChem:902193; 254-357-4; Whiskey lactone; 39212-23-2; 5-butyl-4-methyloxolan-2-one; Methyloctalactone; Quercuslactone a; methyl octalactone; 2(3H)-Furanone, 5-butyldihydro-4-methyl-

    Regulatory listings held on file

    Regulatory & Food ContactFDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Butter, Cocoa, Coconut
    No safety concern at current levels of intake when used as a flavouring agent
    TRS 884-JECFA 49/42
    GHS notification summary86% (239 / 278)

    GHS hazard classification

    GHS notification summary86% (239 / 278)
    Reported hazard statementsH315 (14%), H319 (14%), H335 (13.7%)

    This chemical does not meet GHS hazard criteria for 86% (239 of 278) of all reports.

    H315 (14%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    whisky lactone · CAS 39212-23-2 · C9H16O2. UNII HKX8Y5BUAO. Boiling Point: 93-94 °C; Density: 1.442-1.446; Refractive Index: 0.952.

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

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中文页面: 威士忌内酯

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