Ethyl 2-furoate
Properties
- Molecular formula
- C7H8O3
- Molar mass
- 140.14 g/mol
- Exact mass
- 140.0473 Da
- Density
- 1.1174 g/mL (at 21 °C)
- Melting point
- 34.5 °C
- Boiling point
- 196.8 °C
- logP
- 1.46Crippen estimate
- Polar surface area
- 39.4 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Not classified as hazardous under GHS by 90 ECHA notifiers. Aggregated from 90 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Identifiers
CAS number
614-99-3SMILES
CCOC(=O)c1ccco1InChIKey
NHXSTXWKZVAVOQ-UHFFFAOYSA-NInChI
InChI=1S/C7H8O3/c1-2-9-7(8)6-4-3-5-10-6/h3-5H,2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- 2-Furancarboxylic acid, ethyl ester
- 2-Furoic acid, ethyl ester
- 2-Carboethoxyfuran
- Ethyl pyromucate
- Ethyl 2-furancarboxylate
- Ethyl 2-furylcarboxylate
- 2-(Ethoxycarbonyl)furan
- Ethyl α-furoate
- NSC 2304
Work with Ethyl 2-furoate
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Diethyl 2,5-furandicarboxylate53662-83-263 % similar
Methyl 2-furoate611-13-261 % similar
Ethyl 3-(2-furyl)-3-oxopropanoate615-09-861 % similar
Diethyl phthalate84-66-259 % similar
Ethyl oxazole-5-carboxylate118994-89-154 % similar
Diethyl terephthalate636-09-953 % similar
Ethyl benzoate93-89-053 % similar
2-Benzofurancarboxylic acid ethyl ester3199-61-953 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.