Methyl tetrahydro-2-furancarboxylate

C₆H₁₀O₃CAS 37443-42-8130.14 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₁₀O₃
Molar mass: 130.14 g/mol
Exact mass: 130.0630 Da
Density: 1.108 g/mL (at 20 °C)
Boiling point: 179.5–180.5 °C (at 736 Torr)
logP: 0.34Crippen estimate
Polar surface area: 35.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

37443-42-8

SMILES

COC(=O)C1CCCO1

InChIKey

IXHZGHPQQTXOKV-UHFFFAOYSA-N

InChI

InChI=1S/C6H10O3/c1-8-6(7)5-3-2-4-9-5/h5H,2-4H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

5 names

2-Furancarboxylic acid, tetrahydro-, methyl ester
2-Furoic acid, tetrahydro-, methyl ester
Tetrahydro-2-furancarboxylic acid methyl ester
Tetrahydro-2-furoic acid methyl ester
Methyl 2-tetrahydrofuroate

Work with Methyl tetrahydro-2-furancarboxylate

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl tetrahydrofuroate16874-34-361 % similar Methyl (2R)-2-oxiranecarboxylate111058-32-359 % similar Methyl cyclopropanecarboxylate2868-37-350 % similar 1,4-Dimethyl trans-1,4-cyclohexanedicarboxylate3399-22-250 % similar Methyl cyclohexanecarboxylate4630-82-450 % similar Dimethyl 1,4-cyclohexanedicarboxylate94-60-050 % similar Methyl tetrahydropyran-4-carboxylate110238-91-048 % similar Tetrahydro-2-furoic acid16874-33-248 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl 2-(hydroxymethyl)-2-propenoate10029-04-6 Ethyl 4-hydroxycrotonate10080-68-9 Ethyl (2S)-2-oxiraneacetate112083-63-3 Propionic anhydride123-62-6 3-(2-Propyn-1-yloxy)-1,2-propanediol13580-38-6 2-Hydroxyadipaldehyde141-31-1 Ethyl acetoacetate141-97-9 (±)-3-Methyl-2-oxovaleric acid1460-34-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook