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2-Methylpropyl 2-furanpropanoate

2-Methylpropyl 2-furanpropanoate structure

CAS No:
105-01-1
Formula:
C11H16O3
Chemical Name:
2-Methylpropyl 2-furanpropanoate
Synonyms:
2-Furanpropanoic acid,2-methylpropyl ester;2-Furanpropionic acid,isobutyl ester;2-Methylpropyl 2-furanpropanoate;Isobutyl 2-furanpropionate;Isobutyl furylpropionate;Isobutyl 3-(2-furan)propionate
Categories:
Cosmetic Ingredient > Perfuming

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Description

Colourless to pale, straw-yellow liquid; Fruity, winey, brandy-like aroma

Isobutyl 2-furanpropionate is a fatty acid ester.

2-Methylpropyl 2-furanpropanoate Basic Attributes

Molecular Weight：

196.24

Exact Mass：

196.24

EC Number：

203-261-0

UNII：

VTW5O0BY7T

DSSTox ID：

DTXSID4051532

HScode：

2932190090

Characteristics

PSA：

39.44000

XLogP3：

2.41140

Appearance：

Colourless to pale, straw-yellow liquid; Fruity, winey, brandy-like aroma

Density：

1.004 g/cm³ @ Temp: 25 °C

Boiling Point：

119-120 °C @ Press: 30 Torr

Flash Point：

106.6ºC

Refractive Index：

1.465

Water Solubility：

Very slightly soluble in water

Vapor Pressure：

0.0249mmHg at 25°C

Safety Information

hazard class code：

22-27

safety instructions：

28-36/37-45

Marks：

T+

Precautionary statement(s)：

P264, P270, P280, P301+P312, P302+P352, P312, P322, P330, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P302+P352, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 345 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Methylpropyl 2-furanpropanoate Use and Manufacturing

Methods of Manufacturing

It is formed by direct esterification of 2-furylpropionic acid and isobutanol.

Uses

It is stipulated as a permitted food spice.

Manufacturing Info：

2-Furanpropanoic acid, 2-methylpropyl ester: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:196.24
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:196.109944368
Monoisotopic Mass:196.109944368
Topological Polar Surface Area:39.4
Heavy Atom Count:14
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Isobutanol

Recommended Suppliers of 2-Methylpropyl 2-furanpropanoate

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

CN
4 YRS

Business licensed Certified factory

Manufactory Supplier of Chemical Pesticides,Food Additives,Agrochemicals,Active Pharm Ingredients,Flavors and Fragrances,Chemical Catalyst,Chemical Materials,Chem&Pharm Intermediates,Organic Intermediates,Feed Additive

Isobutyl furfurylacetate -a

CAS No.: 105-01-1

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Guide of 2-Methylpropyl 2-furanpropanoate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Material
Recommended Suppliers
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2-Methylpropyl 2-furanpropanoate

SDS

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