(+)-3-Hydroxytetrahydrofuran

C₄H₈O₂CAS 86087-23-288.11 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₈O₂
Molar mass: 88.11 g/mol
Exact mass: 88.0524 Da
Boiling point: 80 °C (at 15 Torr)
logP: -0.23Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0
Stereocentres: Sin SMILES atom order

Hazards

Warning

H315 Causes skin irritation98.2% of notifiers
H319 Causes serious eye irritation98.2% of notifiers
H335 May cause respiratory irritation96.4% of notifiers

Aggregated from 56 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

86087-23-2

SMILES

O[C@H]1CCOC1

InChIKey

XDPCNPCKDGQBAN-BYPYZUCNSA-N

InChI

InChI=1S/C4H8O2/c5-4-1-2-6-3-4/h4-5H,1-3H2/t4-/m0/s1

Weigh it out

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

Names and synonyms

11 names

3-Furanol, tetrahydro-, (3S)-
3-Furanol, tetrahydro-, (S)-
(3S)-Tetrahydro-3-furanol
(S)-Tetrahydro-3-furanol
(S)-(+)-3-Hydroxytetrahydrofuran
(S)-3-Hydroxytetrahydrofuran
3S-Hydroxytetrahydrofuran
(S)-(+)-Tetrahydrofuran-3-ol
(3S)-Tetrahydrofuran-3-ol
(3S)-Oxolan-3-ol
3-Furanol tetrahydro-, (3S)-

Work with (+)-3-Hydroxytetrahydrofuran

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

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.

(-)-3-Hydroxytetrahydrofuran86087-24-3Enantiomer 3-Hydroxytetrahydrofuran453-20-3Stereo not defined

Similar compounds

Tetrahydro-2H-pyran-3-ol19752-84-270 % similar Tetrahydro-4H-pyran-4-ol2081-44-967 % similar Oxetan-3-ol7748-36-956 % similar 1,3-Dioxan-5-ol4740-78-750 % similar Diglycerin59113-36-945 % similar Diglycerin627-82-745 % similar 1,3-Diethoxy-2-propanol4043-59-843 % similar Polyglycerin-356090-54-143 % similar

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

Same formula

3-Hydroxybutanal107-89-1 Butyric acid107-92-6 2-Butene-1,4-diol110-64-5 Propyl formate110-74-7 1,4-Dioxane123-91-1 Ethyl acetate141-78-6 1,4-Dioxane-D817647-74-4 2-Methylene-1,3-propanediol3513-81-3

Elsewhere

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