2-Ethyl-4H-chromen-4-one

C11H10O2CAS 14736-30-2174.20 g/mol

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Properties

Molecular formula
C11H10O2
Molar mass
174.20 g/mol
Exact mass
174.0681 Da
logP
2.36Crippen estimate
Polar surface area
30.2 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
14736-30-2
SMILES
CCC1=CC(=O)C2=CC=CC=C2O1
InChIKey
KTVKQTNGWVJHFL-UHFFFAOYSA-N
InChI
InChI=1S/C11H10O2/c1-2-8-7-10(12)9-5-3-4-6-11(9)13-8/h3-7H,2H2,1H3

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Names and synonyms

6 names
  • 2-Ethylchromen-4-one
  • 2-Ethylchromone
  • 4H-1-Benzopyran-4-one, 3-ethyl-
  • 2-Ethyl-4h-1-benzopyran-4-one
  • Ethylchromone
  • 2-Ethyl-chromen-4-one

Reactions

Work with 2-Ethyl-4H-chromen-4-one

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-Ethylbenzofuran3131-63-356 % similar Flavone525-82-651 % similar 4-Oxo-4H-1-benzopyran-2-carboxylic acid4940-39-046 % similar 3',4'-Dimethoxyflavone4143-62-843 % similar 3',4'-Dihydroxyflavone4143-64-043 % similar 4-Ethoxycoumarin35817-27-742 % similar Chromone491-38-342 % similar Xanthone90-47-141 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Phenyl-2,4-pentadienoic acid1552-94-9 Propylidenephthalide17369-59-4 1,2,6,7-Tetrahydro-8H-indeno[5,4-b]furan-8-one196597-78-1 Ethyl phenylpropiolate2216-94-6 Vinyl trans-cinnamate3098-92-8 6-Methoxy-2-naphthol5111-66-0 1-Phenyl-2-oxo-3-oxabicyclo[3.1.0]hexane63106-93-4 4-Methoxy-1-naphthol84-85-5

Elsewhere

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