γ-Hexalactone

CAS 823-22-3C6H10O2MW 114.07 g/mol

γ-Hexalactone (CAS 823-22-3) — formula C6H10O2, molecular weight 114.07 g/mol.

Specifications

CAS Number823-22-3

Molecular FormulaC6H10O2

Molecular Weight114.07 g/mol

Melting Point31.00 °C. @ 760.00 mm Hg

Boiling Point110.00 to 112.00 °C. @ 15.00 mm Hg

LogP1

ApplicationsUse Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Where it is used

Documented applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes.

Purchase Profile

What this product is

γ-Hexalactone is a chemical compound with CAS registry number 823-22-3 and molecular formula C6H10O2 (molecular weight 114.07 g/mol).

Identification

CAS number: 823-22-3

Its molecular formula C6H10O2 comprises 6 C, 10 H, 2 O atoms.

Also known as: γ-Hexalactone · delta-Hexanolactone

Frequently Asked Questions

What is the CAS number of γ-Hexalactone?

The CAS registry number of γ-Hexalactone is 823-22-3.

What is the molecular formula and molecular weight of γ-Hexalactone?

Molecular formula C6H10O2, molecular weight 114.07 g/mol.

What other names is γ-Hexalactone known by?

It is also registered under: γ-Hexalactone, delta-Hexanolactone.

What are the documented applications of γ-Hexalactone?

Recorded applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes.

PubChem Public Data

Public-database records for γ-Hexalactone (CAS 823-22-3), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary	7% (101 / 1451)
Reported hazard statements	H319 (93%)

This chemical does not meet GHS hazard criteria for 7% (101 of 1451) of reports.

H319 (93%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

Regulatory listings

Regulatory & Food Contact	FDA Substance added to food: FLAVORING AGENT OR ADJUVANT FLAVOURING_AGENT: Flavouring Agent Flavoring Agents Spice No safety concern at current levels of intake when used as a flavouring agent TRS 884-JECFA 49/42
GHS notification summary	7% (101 / 1451)

Physical description and handling notes

Solid
colourless to pale yellowish liquid with a creamy, fruity, coconut odour
soluble in alcohol, oil, propylene glycol, and ether; slightly soluble in water
(in ethanol)

Reported physical properties

沸点	110.00 to 112.00 °C. @ 15.00 mm Hg
沸点	110-112 °C (15 mm Hg)
熔点	31.00 °C. @ 760.00 mm Hg
密度	1.0162 (20 °C/20 °C)
折射率	1.449-1.453

How this substance is indexed

CAS Registry Number	823-22-3
PubChem CID	13204
分子式	C6H10O2
分子量	114.07 g/mol
IUPAC 名称	6-methyloxan-2-one
InChIKey	RZTOWFMDBDPERY-UHFFFAOYSA-N
UNII（FDA）	C8456O4551
ChEBI 编号	CHEBI:172408
FEMA 编号	3167
JECFA 编号	224

Documented uses

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index

Names this substance appears under

823-22-3; delta-Hexalactone; delta-Hexanolactone; 6-methyloxan-2-one; delta-Caprolactone; 5-Methyl-delta-valerolactone; 5-Hydroxyhexanoic acid lactone; .delta.-Caprolactone; 2H-Pyran-2-one, tetrahydro-6-methyl-; Tetrahydro-6-methyl-2H-pyran-2-one; Hexanolactone; 5-Hexanolide; .delta.-Hexalactone; 6-Methyltetrahydro-2H-pyran-2-one; 6-Methylvalerolactone; delta-Methyl-delta-valerolactone

Computed molecular descriptors

分子量	114.14
XLogP3	1
氢键供体数	0
氢键受体数	2
可旋转键数	0
精确质量	114.068079557
单同位素质量	114.068079557
拓扑极性表面积	26.3
重原子数	8
形式电荷	0

Database abstract

γ-Hexalactone is identified by CAS 823-22-3, molecular formula C6H10O2 and molecular weight 114.07 g/mol. UNII C8456O4551; ChEBI 172408; InChIKey RZTOWFMDBDPERY-UHFFFAOYSA-N. 沸点: 110.00 to 112.00 °C. @ 15.00 mm Hg; 沸点: 110-112 °C (15 mm Hg); 熔点: 31.00 °C. @ 760.00 mm Hg.

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

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