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(E)-Ethyl 3-(2-furyl)acrylate

HCID 699489
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
53282-12-5
Standard SMILES
CCOC(=O)/C=C/c1ccco1
InChIKey
MWZBTMXISMOMAE-AATRIKPKSA-N
Molecular formula
C9H10O3
Average molar mass
166.17 g/mol

Overview

(E)-ethyl 3-(2-furyl)acrylate is an ethyl 3-(2-furyl)acrylate in which the double bond adopts a trans-configuration. It has a role as a flavouring agent.

Names & identifiers

Preferred name
(E)-Ethyl 3-(2-furyl)acrylate
IUPAC
ethyl (E)-3-(furan-2-yl)prop-2-enoate
English name
2-Propenoic acid, 3-(2-furanyl)-, ethyl ester, (2E)-
Molecular formula
C9H10O3
Molecular weight
166.17

Names & synonyms

Ethyl 3-(2-furyl)acrylate623-20-1Ethyl trans-2-furanacrylateethyl (2E)-3-(furan-2-yl)prop-2-enoateethyl (E)-3-(furan-2-yl)acrylate(E)-Ethyl 3-(2-furyl)acrylate(E)-Ethyl 3-furan-2-ylacrylate(E)-Ethyl 3-(2-furyl)-2-propenoate89NQL84I8H(E)-ethyl furfuracrylateEthyl 3-(2-furyl)-acrylate2-Propenoic acid, 3-(2-furanyl)-, ethyl ester
Show more names
Ethyl-2E-3-2-furylacrylateethyl (E)-3-(2-furyl) acrylate2-Propenoic acid, 3-(2-furanyl)-, ethyl ester, (2E)-
2-Furanacrylic acid ethyl esterEINECS 210-778-5AI3-04246FEMA 4541CHEBI:173754CHEBI:189588(2E)-ethyl 3-(2-furyl)acrylateETHYL FURFURACRYLATE, (E)-

Database identifiers

CAS
53282-12-5、623-20-1
PubChem CID
699489
ChEBI
CHEBI:189588
UNII

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
39.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
175

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density1.090-1.096
Flavoring AgentsEU Flavoring substances
Solubility · 2 items

Practically insoluble to insoluble in water

Soluble (in ethanol)

Boiling Point230-233 °C
Refractive Index1.542-1.548
Physical DescriptionViscous liquid; Sweet aroma

Physicochemical properties

Melting point
24 · 24-26 °C
Boiling point
235 °C · 235 °C

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory Information · 3 items

Chemical: 2-Propenoic acid, 3-(2-furanyl)-, ethyl ester

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

2-Propenoic acid, 3-(2-furanyl)-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard

Chemistry & industry

Uses & manufacturing

Use Classification · 2 items

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Suppliers5 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]

Additional notes

DefinitionChEBI: (E)-ethyl 3-(2-furyl)acrylate is an ethyl 3-(2-furyl)acrylate in which the double bond adopts a trans-configuration. It has a role as a flavouring agent.

Related reactions

3 records
New reaction record
HRID 16730 reaction equation
HRID 16730As reactantuspto-grants-2010_06
HRID 1092001 reaction equation
HRID 1092001As reactantuspto-grants-2012_03
HRID 1911302 reaction equation
HRID 1911302As reactantuspto-grants-2013_12

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
89NQL84I8H
EC Number
210-778-5
Nikkaji
J100.254F、J44.188K
Density
1.0891 g/cm3 · 1.0891 g/cm3
FEMA
4541 · 4541 | (E)-ETHYL 3-(2-FURYL)ACRYLATE
Odor
sweet
JECFA Number
2103 · 2103
LogP
2.33 · 2.33
Substances Added to Food (formerly EAFUS)
3 · (E)-ETHYL 3-(2-FURYL)ACRYLATE
FDA UNII
89 NQL84I8H · 89NQL84I8H