2'-Ethylpropiophenone

C₁₁H₁₄OCAS 16819-79-7162.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₄O
Molar mass: 162.23 g/mol
Exact mass: 162.1045 Da
logP: 2.84Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

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

Identifiers

CAS number

16819-79-7

SMILES

CCC1=CC=CC=C1C(=O)CC

InChIKey

RESNKGBFZAPADB-UHFFFAOYSA-N

InChI

InChI=1S/C11H14O/c1-3-9-7-5-6-8-10(9)11(12)4-2/h5-8H,3-4H2,1-2H3

Weigh it out

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

Work with 2'-Ethylpropiophenone

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′-Hydroxypropiophenone610-99-158 % similar 2-Ethylbenzoic acid612-19-158 % similar 2-(Trifluoromethyl)propiophenone16185-96-954 % similar Propiophenone93-55-052 % similar 1-Indanone83-33-050 % similar 1,2-Diethylbenzene135-01-348 % similar 1-Tetralone529-34-047 % similar 3,4-Dihydro-1H-2-benzopyran-4-one20924-56-546 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Valerophenone1009-14-9 4-Butylbenzaldehyde1200-14-2 2′,4′,6′-Trimethylacetophenone1667-01-2 1-(2,4,5-Trimethylphenyl)ethanone2040-07-5 Allyl alcohol-styrene copolymer25119-62-4 4'-Ethylpropiophenone27465-51-6 3-Methyl-1-phenyl-2-butanone2893-05-2 1-(4-Propylphenyl)ethanone2932-65-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook