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C₁₀H₁₀O₄CAS 18607-90-4194.19 g/mol

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Properties

Molecular formula: C₁₀H₁₀O₄
Molar mass: 194.19 g/mol
Exact mass: 194.0579 Da
Melting point: 110 °C
logP: 1.71Crippen estimate
Polar surface area: 55.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 2

Identifiers

CAS number

18607-90-4

SMILES

CCC(=O)c1cc2c(cc1O)OCO2

InChIKey

SLLMHZXMVHNZOR-UHFFFAOYSA-N

InChI

InChI=1S/C10H10O4/c1-2-7(11)6-3-9-10(4-8(6)12)14-5-13-9/h3-4,12H,2,5H2,1H3

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

Names and synonyms

4 names

1-Propanone, 1-(6-hydroxy-1,3-benzodioxol-5-yl)-
Propiophenone, 2′-hydroxy-4′,5′-(methylenedioxy)-
1-(6-Hydroxy-1,3-benzodioxol-5-yl)-1-propanone
2-Hydroxy-4,5-methylenedioxypropiophenone

Work with Kakuol

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

Same formula

1,3-Dihydroxybenzene diacetate108-58-7 Ferulic acid1135-24-6 1,4-Diacetoxybenzene1205-91-0 Dimethyl terephthalate120-61-6 Dimethyl phthalate131-11-3 Dimethyl isophthalate1459-93-4 Methyl 5-acetylsalicylate16475-90-4 4-Acetylphenoxyacetic acid1878-81-5

Elsewhere

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