1,1,3-Trimethoxypropane

C₆H₁₄O₃CAS 14315-97-0134.17 g/mol

Open in Covalent MOL file

Acetal Ether

Properties

Molecular formula: C₆H₁₄O₃
Molar mass: 134.17 g/mol
Exact mass: 134.0943 Da
Density: 0.941 g/mL (at 20 °C)
Boiling point: 45–46 °C
logP: 0.64Crippen estimate
Polar surface area: 27.7 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 5

Hazards

Warning

H226 Flammable liquid and vapor100% of notifiers
H315 Causes skin irritation90.7% of notifiers
H319 Causes serious eye irritation90.7% of notifiers
H335 May cause respiratory irritation90.7% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

14315-97-0

SMILES

COCCC(OC)OC

InChIKey

FKZYYYDRLJCHGL-UHFFFAOYSA-N

InChI

InChI=1S/C6H14O3/c1-7-5-4-6(8-2)9-3/h6H,4-5H2,1-3H3

Weigh it out

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

Names and synonyms

4 names

Propane, 1,1,3-trimethoxy-
Propionaldehyde, 3-methoxy-, dimethyl acetal
3-Methoxypropionaldehyde dimethyl acetal
NSC 280806

Work with 1,1,3-Trimethoxypropane

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

3-Bromo-1,1-dimethoxypropane36255-44-455 % similar 1,1-Dimethoxy-2-(2-methoxyethoxy)ethane94158-44-854 % similar 1,1,2-Trimethoxyethane24332-20-552 % similar 2,5-Dimethoxytetrahydrofuran696-59-348 % similar 1,1,3,3-Tetramethoxypropane102-52-345 % similar Dimethoxyethane110-71-444 % similar Polyethylene glycol dimethyl ether24991-55-744 % similar 4,4-Dimethoxy-1-butanamine19060-15-244 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2,6-Hexanetriol106-69-4 1,1'-Oxydi-2-propanol110-98-5 2-(2-Ethoxyethoxy)ethanol111-90-0 Diglyme111-96-6 1,1,1-Trimethoxypropane24823-81-2 2,2-Diethoxyethanol621-63-6 Trimethylolpropane77-99-6

Elsewhere

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