4-Methyl-2-pentyl-1,3-dioxolane

C₉H₁₈O₂CAS 1599-49-1158.24 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₈O₂
Molar mass: 158.24 g/mol
Exact mass: 158.1307 Da
logP: 2.33Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Identifiers

CAS number

1599-49-1

SMILES

CCCCCC1OCC(C)O1

InChIKey

GWMSIWCZZKMUQM-UHFFFAOYSA-N

InChI

InChI=1S/C9H18O2/c1-3-4-5-6-9-10-7-8(2)11-9/h8-9H,3-7H2,1-2H3

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

Names and synonyms

2 names

1,3-Dioxolane, 4-methyl-2-pentyl-
2-Pentyl-4-methyl-1,3-dioxolane

Work with 4-Methyl-2-pentyl-1,3-dioxolane

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

Isoamyl butyrate106-27-4 Ethyl heptanoate106-30-9 Butyl isovalerate109-19-3 Methyl octanoate111-11-5 Pelargonic acid112-05-0 Heptyl acetate112-06-1 (±)-Butyl 2-methylbutanoate15706-73-7 Isoamyl isobutyrate2050-01-3

Elsewhere

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