2-Methylfuran
Properties
- Molecular formula
- C5H6O
- Molar mass
- 82.10 g/mol
- Exact mass
- 82.0419 Da
- Density
- 0.9159 g/mL (at 20 °C)
- Melting point
- −87.5 °C
- Boiling point
- 65 °C
- Flash point
- -30 °C
- Water solubility
- < 1 g/L (22.5 °C)
- logP
- 1.59Crippen estimate
- Polar surface area
- 13.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H225 Highly Flammable liquid and vapor99.8% of notifiers
- H301 Toxic if swallowed91.7% of notifiers
- H319 Causes serious eye irritation24.4% of notifiers
- H330 Fatal if inhaled23.5% of notifiers
- H331 Toxic if inhaled75.6% of notifiers
- H411 Toxic to aquatic life with long lasting effects22.2% of notifiers
Aggregated from 468 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P303+P361+P353, P304+P340, P305+P351+P338, P316, P320, P321, P330, P337+P317, P370+P378, P391, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
534-22-5SMILES
Cc1ccco1InChIKey
VQKFNUFAXTZWDK-UHFFFAOYSA-NInChI
InChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- Furan, 2-methyl-
- α-Methylfuran
- Silvan
- Sylvan
- 5-Methylfuran
- NSC 3707
- NSC 5211
Work with 2-Methylfuran
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
Similar compounds
2-Methoxyfuran25414-22-640 % similar
2-Ethylfuran3208-16-040 % similar
2,5-Dimethylfuran625-86-540 % similar
Tri(2-furyl)phosphine5518-52-539 % similar
2-Bromofuran584-12-339 % similar
α-Methyl-2-furanmethanol4208-64-437 % similar
2-Propylfuran4229-91-837 % similar
2-Acetylfuran1192-62-736 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.