1,1-Diethoxyhexane

C₁₀H₂₂O₂CAS 3658-93-3174.28 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₂₂O₂
Molar mass: 174.28 g/mol
Exact mass: 174.1620 Da
Boiling point: 155–158 °C
logP: 2.97Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 8

Identifiers

CAS number

3658-93-3

SMILES

CCCCCC(OCC)OCC

InChIKey

WNHOMUCDFNTSEV-UHFFFAOYSA-N

InChI

InChI=1S/C10H22O2/c1-4-7-8-9-10(11-5-2)12-6-3/h10H,4-9H2,1-3H3

Weigh it out

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

Names and synonyms

3 names

Hexane, 1,1-diethoxy-
Hexanal, diethyl acetal
Hexylaldehyde diacetal

Work with 1,1-Diethoxyhexane

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chlorobutyraldehyde diethyl acetal6139-83-958 % similar 4,4-Diethoxy-1-butanamine6346-09-458 % similar 1,1-Dimethoxydecane7779-41-154 % similar 4,4-Diethoxy-N,N-dimethyl-1-butanamine1116-77-454 % similar 4-Methyl-2-pentyl-1,3-dioxolane1599-49-152 % similar 3-Ethoxyhexanal diethyl acetal101-33-750 % similar 1,2-Epoxydecane2404-44-650 % similar 1,2-Epoxydodecane2855-19-850 % similar

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

Same formula

1,1-Dimethoxyoctane10022-28-3 3,7-Dimethyl-1,7-octanediol107-74-4 1,2-Decanediol1119-86-4 1,10-Decanediol112-47-0 Glycol dibutyl ether112-48-1

Elsewhere

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