Dihydrobenzofuran
Properties
- Molecular formula
- C8H8O
- Molar mass
- 120.15 g/mol
- Exact mass
- 120.0575 Da
- Density
- 1.083 g/mL (at 20 °C)
- Melting point
- −21.5 °C
- Boiling point
- 188.5 °C
- logP
- 1.62Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
- H412 Harmful to aquatic life with long lasting effects99% of notifiers
Aggregated from 105 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
496-16-2SMILES
c1ccc2c(c1)CCO2InChIKey
HBEDSQVIWPRPAY-UHFFFAOYSA-NInChI
InChI=1S/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- Benzofuran, 2,3-dihydro-
- Benzofuran, 1,2-dihydro-
- 2,3-Dihydrobenzofuran
- Coumaran
- Kumaran
- 2,3-Dihydrobenzo[b]furan
- Benzodihydrofuran
- 2,3-Dihydro-1-benzofuran
- 2,3-Dihydrobenzofurane
Work with Dihydrobenzofuran
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
Benzodioxan493-09-457 % similar
Benzo-18-crown-614098-24-950 % similar
Benzo-15-crown-514098-44-350 % similar
Benzo-12-crown-414174-08-450 % similar
Dibenzo-24-crown-814174-09-550 % similar
Dibenzo-18-crown-614187-32-750 % similar
Dibenzo-30-crown-1017455-25-350 % similar
5-Bromo-2,3-dihydro-1-benzofuran66826-78-650 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.