2,3-Dimethylbenzofuran

C10H10OCAS 3782-00-1146.19 g/mol

Open in Covalent MOL file
O

Properties

Molecular formula
C10H10O
Molar mass
146.19 g/mol
Exact mass
146.0732 Da
Density
1.031–1.037 g/mL
Boiling point
101–102 °C (at 19 Torr)
logP
3.05Crippen estimate
Polar surface area
13.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 1,375 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
3782-00-1
SMILES
Cc1oc2ccccc2c1C
InChIKey
YGBXXWTZWLALGR-UHFFFAOYSA-N
InChI
InChI=1S/C10H10O/c1-7-8(2)11-10-6-4-3-5-9(7)10/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

2 names
  • Benzofuran, 2,3-dimethyl-
  • 2,3-Dimethyl-1-benzofuran

Work with 2,3-Dimethylbenzofuran

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

Dibenzofuran132-64-950 % similar 3-Methyl-1-benzofuran-2-carboxylic acid24673-56-149 % similar 3-Cyano-4-methylcoumarin24526-69-047 % similar 9,10-Dimethylanthracene781-43-146 % similar 3-Methylbenzofuran-2-carboxylic acid ethyl ester22367-82-443 % similar Xanthone90-47-141 % similar 4-Methylcoumarin607-71-641 % similar 3-Dibenzofuranamine4106-66-539 % 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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