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

C₁₁H₁₀O₂CAS 14736-30-2174.20 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₀O₂
Molar mass: 174.20 g/mol
Exact mass: 174.0681 Da
logP: 2.36Crippen estimate
Polar surface area: 30.2 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

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

Weigh it out

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

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

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 Chromone491-38-342 % similar Xanthone90-47-141 % similar 2-(2-Amino-3-methoxyphenyl)-4H-1-benzopyran-4-one167869-21-840 % 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 1-Phenyl-2-oxo-3-oxabicyclo[3.1.0]hexane63106-93-4 4-Methoxy-1-naphthol84-85-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook