2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate

Name: 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate
Brand: Jinan Shenghe Chemical Co., Ltd.
SKU: 160708

CAS 114099-96-6C10H14O4MW 198.22

2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate (CAS 114099-96-6) — formula C10H14O4, molecular weight 198.22.

Specifications

CAS Number114099-96-6

Molecular FormulaC10H14O4

Molecular Weight198.22

Boiling Point287 °C

LogP1.6

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

2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate is a chemical compound with CAS registry number 114099-96-6 and molecular formula C10H14O4 (molecular weight 198.22).

Identification

CAS number: 114099-96-6

Its molecular formula C10H14O4 comprises 10 C, 14 H, 4 O atoms.

Also known as: 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate · Furanone Butyrate · Fraision Butyrate

Frequently Asked Questions

What is the CAS number of 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate?

The CAS registry number of 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate is 114099-96-6.

What is the molecular formula and molecular weight of 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate?

Molecular formula C10H14O4, molecular weight 198.22.

What other names is 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate known by?

It is also registered under: 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate, Furanone Butyrate, Fraision Butyrate.

What are the documented applications of 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate?

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 2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate (CAS 114099-96-6), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary	100% (90 / 90)

This chemical does not meet GHS hazard criteria for 100% (90 of 90) of all reports.

Reported as not meeting GHS hazard criteria by 90 of 90 companies. For more detailed information, please visit ECHA C&L website.

Regulatory listings

Regulatory & Food Contact	EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary	100% (90 / 90)

Physical description and handling notes

Colourless to pale yellow liquid; Spicy, sweet aroma
Insoluble in water
Soluble (in ethanol)

Reported physical properties

沸点	287 °C
密度	1.095-1.103
折射率	1.467-1.473

How this substance is indexed

CAS Registry Number	114099-96-6
PubChem CID	19872333
分子式	C10H14O4
IUPAC 名称	(2,5-dimethyl-4-oxofuran-3-yl) butanoate
UNII（FDA）	9DX0J398K6
FEMA 编号	3970
JECFA 编号	1519

Documented uses

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

Names this substance appears under

114099-96-6; 4-BUTYROXY-2,5-DIMETHYL-3(2H)-FURANONE; furaneyl butyrate; Butanoic acid, 4,5-dihydro-2,5-dimethyl-4-oxo-3-furanyl ester; FEMA No. 3970; 2,5-Dimethyl-3-oxo-(2H)-fur-4-yl butyrate; 9DX0J398K6; 4,5-DIHYDRO-2,5-DIMETHYL-4-OXO-3-FURANYL BUTYRATE; 2,5-Dimethyl-3-oxo-(2H)-fur-4-yl butyrate [FIFH]; 2,5-DIMETHYL-3-OXO-(2H)-FUR-4-YL BUTYRATE [FHFI]; 2,5-Dimethyl-3-oxo-(2H)-fur-4-yl butyrate (FIFH); RefChem:520648; (+-)-2,5-DIMETHYL-3-OXO-(2H)-FUR-4-YL BUTYRATE; 2,5-DIMETHYL-3-OXO-(2H)-FUR-4-YL BUTYRATE, (+-)-; 601-298-0; 928-463-2

Computed molecular descriptors

分子量	198.22
XLogP3	1.6
氢键供体数	0
氢键受体数	4
可旋转键数	4
精确质量	198.08920892
单同位素质量	198.08920892
拓扑极性表面积	52.6
重原子数	14
形式电荷	0

Database abstract

2,5-Dimethyl-3-Oxo-(2H)-fur-4-yl butyrate · CAS 114099-96-6 · C10H14O4. UNII 9DX0J398K6. 沸点: 287 °C; 密度: 1.095-1.103; Refractive Index: 1.467-1.473.

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

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