2-Ethylbenzofuran

C10H10OCAS 3131-63-3146.19 g/mol

Open in Covalent MOL file
O

Properties

Molecular formula
C10H10O
Molar mass
146.19 g/mol
Exact mass
146.0732 Da
Boiling point
217–218 °C (at 742 Torr)
logP
3.00Crippen estimate
Polar surface area
13.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 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
3131-63-3
SMILES
CCc1cc2ccccc2o1
InChIKey
KJHYAEZMOHLVCH-UHFFFAOYSA-N
InChI
InChI=1S/C10H10O/c1-2-9-7-8-5-3-4-6-10(8)11-9/h3-7H,2H2,1H3

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Names and synonyms

3 names
  • Benzofuran, 2-ethyl-
  • 2-Ethylbenzo[b]furan
  • 2-Ethyl-1-benzofuran

Work with 2-Ethylbenzofuran

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

2-Butylbenzofuran4265-27-463 % similar 2-Benzofuranmethanol55038-01-260 % similar 2-Ethyl-4H-chromen-4-one14736-30-256 % similar R-(-)-BPAP260550-89-849 % similar 2-Bromo-1-benzofuran54008-77-445 % similar 2-Benzofurancarboxylic acid ethyl ester3199-61-943 % similar 2-Acetylbenzofuran1646-26-042 % similar 2-Benzofurancarboxaldehyde4265-16-141 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

α-Methylcinnamaldehyde101-39-3 4-Phenyl-3-buten-2-one122-57-6 2-Phenyl-3-butyn-2-ol127-66-2 trans-4-Phenyl-3-buten-2-one1896-62-4 4-Ethenyl-2,3-dihydrobenzofuran230642-84-9 6-Methyl-1-indanone24623-20-9 4-Methyl-1-indanone24644-78-8 5,8-Dihydro-1-naphthol27673-48-9

Elsewhere

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