2-(2-Aminoethoxy)-1,1-dimethoxyethane

C₆H₁₅NO₃CAS 1228258-40-9149.19 g/mol

Open in Covalent MOL file

Acetal Ether Primary amine

Properties

Molecular formula: C₆H₁₅NO₃
Molar mass: 149.19 g/mol
Exact mass: 149.1052 Da
logP: -0.42Crippen estimate
Polar surface area: 53.7 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 6

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, P501

Identifiers

CAS number

1228258-40-9

SMILES

COC(COCCN)OC

InChIKey

CBEGMMFTEUNTQO-UHFFFAOYSA-N

InChI

InChI=1S/C6H15NO3/c1-8-6(9-2)5-10-4-3-7/h6H,3-5,7H2,1-2H3

Weigh it out

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

Work with 2-(2-Aminoethoxy)-1,1-dimethoxyethane

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

1,1-Dimethoxy-2-(2-methoxyethoxy)ethane94158-44-858 % similar 4,4-Dimethoxy-1-butanamine19060-15-248 % similar 2-Aminoethyl ether2752-17-245 % similar 2,5,8,11,14,17-Hexaoxanonadecan-19-amine184357-46-844 % similar 2-(2-Methoxyethoxy)ethanamine31576-51-944 % similar 2-[2-(2-Methoxyethoxy)ethoxy]ethanamine74654-07-244 % similar Aminopoly(ethylene glycol) methyl ether80506-64-544 % similar Aminoacetaldehyde dimethyl acetal22483-09-644 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Triethanolamine102-71-6 2-[2-(2-Aminoethoxy)ethoxy]ethanol6338-55-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook