5-Hydroxy-4-propyl-2(5H)-furanone

C₇H₁₀O₃CAS 78920-10-2142.15 g/mol

Open in Covalent MOL file

Alcohol Alkene Ester Lactone

Properties

Molecular formula: C₇H₁₀O₃
Molar mass: 142.15 g/mol
Exact mass: 142.0630 Da
Boiling point: 115 °C (at 0.01 Torr)
logP: 0.59Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Identifiers

CAS number

78920-10-2

SMILES

CCCC1=CC(=O)OC1O

InChIKey

KQMCGGGTJKNIMC-UHFFFAOYSA-N

InChI

InChI=1S/C7H10O3/c1-2-3-5-4-6(8)10-7(5)9/h4,7,9H,2-3H2,1H3

Weigh it out

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

Names and synonyms

3 names

2(5H)-Furanone, 5-hydroxy-4-propyl-
5-Hydroxy-4-propyl-5H-furan-2-one
2-Hydroxy-3-propyl-2H-furan-5-one

Work with 5-Hydroxy-4-propyl-2(5H)-furanone

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

5-Hydroxy-4-methyl-2(5H)-furanone40834-42-250 % similar 1,4-Dipropyl (2Z)-2-butenedioate2432-63-537 % similar Dibutyl fumarate105-75-935 % similar Dibutyl maleate105-76-035 % similar Isopropyl butanoate638-11-935 % similar Propyl butyrate105-66-833 % similar Methyl 2-hexenoate2396-77-233 % similar Di-N-octyl maleate2915-53-933 % similar

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

Same formula

Methyl 2-oxocyclopentanecarboxylate10472-24-9 Glycidyl methacrylate106-91-2 Allyl acetoacetate1118-84-9 4-(Acetyloxy)-2-methyl-2-butenal14918-80-0 Ethyl 3-oxopent-4-enoate22418-80-0 5-Ethyl-4-hydroxy-2-methyl-3(2H)-furanone27538-09-6 Homofuraneol27538-10-9 2,2-Dimethylglutaric anhydride2938-48-9

Elsewhere

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