Tetrahydrofurfuryl alcohol
Properties
- Molecular formula
- C5H10O2
- Molar mass
- 102.13 g/mol
- Exact mass
- 102.0681 Da
- Density
- 1.0544 g/mL (at 20 °C)
- Melting point
- below −80 °C
- Boiling point
- 178 °C
- Flash point
- 74 °C (closed cup)
- Water solubility
- miscible
- logP
- 0.16Crippen estimate
- Polar surface area
- 29.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H319 Causes serious eye irritationSerious eye damage/eye irritation
- H360Df May damage the unborn child; Suspected of damaging fertilityReproductive toxicity
Harmonised EU classification (CLP Annex VI, index 603-061-00-7), via PubChem.
Precautionary statements
P203, P264+P265, P280, P305+P351+P338, P318, P337+P317, P405, P501
Identifiers
CAS number
97-99-4SMILES
OCC1CCCO1InChIKey
BSYVTEYKTMYBMK-UHFFFAOYSA-NInChI
InChI=1S/C5H10O2/c6-4-5-2-1-3-7-5/h5-6H,1-4H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
14 names · show all
- 2-Furanmethanol, tetrahydro-
- Furfuryl alcohol, tetrahydro-
- Tetrahydro-2-furanmethanol
- QO THFA
- Tetrahydro-2-furancarbinol
- Tetrahydro-2-furylmethanol
- THFA
- 2-(Hydroxymethyl)tetrahydrofuran
- Tetrahydro-2-furanylmethanol
- rac-(Tetrahydrofuran-2-yl)methanol
- NSC 15434
- (Tetrahydrofuran-2-yl)methanol
- (±)-Tetrahydrofurfuryl alcohol
- (Oxolan-2-yl)methanol
Work with Tetrahydrofurfuryl alcohol
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
2-(Hydroxymethyl)tetrahydropyran100-72-185 % similar
2-Hydroxymethyloxetane61266-70-470 % similar
Tetrahydrofurfuryl polyethylene glycol31692-85-052 % similar
2-(Bromomethyl)tetrahydrofuran1192-30-950 % similar
(R)-2-Hydroxymethylmorpholine156925-22-350 % similar
2-Chloromethyl tetrahydrofuran3003-84-750 % similar
Tetrahydrofurfurylamine4795-29-350 % similar
(S)-(+)-Tetrahydrofurfurylamine7175-81-750 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.