1-[2,4,6-Tris(1-methylethyl)phenyl]ethanone

C₁₇H₂₆OCAS 2234-14-2246.39 g/mol

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Properties

Molecular formula: C₁₇H₂₆O
Molar mass: 246.39 g/mol
Exact mass: 246.1984 Da
Melting point: 87.5–88 °C
logP: 5.26Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 4

Identifiers

CAS number

2234-14-2

SMILES

CC(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C

InChIKey

SGRDDUKVLKWIBZ-UHFFFAOYSA-N

InChI

InChI=1S/C17H26O/c1-10(2)14-8-15(11(3)4)17(13(7)18)16(9-14)12(5)6/h8-12H,1-7H3

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Names and synonyms

8 names

Ethanone, 1-[2,4,6-tris(1-methylethyl)phenyl]-
Acetophenone, 2′,4′,6′-triisopropyl-
2′,4′,6′-Triisopropylacetophenone
2,4,6-Triisopropylacetophenone
1-(2,4,6-Triisopropylphenyl)ethanone
NSC 152212
1-[2,4,6-Tri(propan-2-yl)phenyl]ethanone
1-(2,4,6-Triisopropylphenyl)ethan-1-one

Work with 1-[2,4,6-Tris(1-methylethyl)phenyl]ethanone

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

2,4,6-Tris(1-methylethyl)benzoic acid49623-71-459 % similar 1-[4-(1-Methylethyl)phenyl]ethanone645-13-655 % similar 1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone1202-08-046 % similar 3,5-Diisopropylsalicylic acid2215-21-644 % similar 1,1′,1′′-(1,3,5-Benzenetriyl)tris[ethanone]779-90-843 % similar 1,3,5-Triisopropylbenzene717-74-842 % similar 2,4,6-Tris(1-methylethyl)benzenesulfonyl chloride6553-96-442 % similar 2,4,6-Triisopropylbenzenesulfonyl hydrazide39085-59-139 % similar

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

Same formula

Acetylcedrene32388-55-9 1-(4-Nonylphenyl)ethanone37593-05-8 1-Ethoxy-4-(trans-4-propylcyclohexyl)benzene80944-44-1 4-(trans-4-Pentylcyclohexyl)phenol82575-69-7

Elsewhere

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