1,1-Bis(2,2-dimethylpropoxy)-N,N-dimethylmethanamine

C₁₃H₂₉NO₂CAS 4909-78-8231.38 g/mol

Open in Covalent MOL file

Acetal Ether Tertiary amine

Properties

Molecular formula: C₁₃H₂₉NO₂
Molar mass: 231.38 g/mol
Exact mass: 231.2198 Da
Melting point: 253.5 °C
logP: 2.96Crippen estimate
Polar surface area: 21.7 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 5

Hazards

Warning

H226 Flammable liquid and vapor97.5% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.5% of notifiers

Aggregated from 40 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

4909-78-8

SMILES

CN(C)C(OCC(C)(C)C)OCC(C)(C)C

InChIKey

KEXFRBIOHPDZQM-UHFFFAOYSA-N

InChI

InChI=1S/C13H29NO2/c1-12(2,3)9-15-11(14(7)8)16-10-13(4,5)6/h11H,9-10H2,1-8H3

Weigh it out

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

Names and synonyms

6 names

Methanamine, 1,1-bis(2,2-dimethylpropoxy)-N,N-dimethyl-
Trimethylamine, 1,1-bis(neopentyloxy)-
Dimethylformamide dineopentyl acetal
N,N-Dimethylformamide dineopentyl acetal
DMF dineopentyl acetal
Dimethylformamide bis(2,2-dimethylpropyl) acetal

Work with 1,1-Bis(2,2-dimethylpropoxy)-N,N-dimethylmethanamine

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

N,N-Dimethyl-1,3-dioxolan-2-amine19449-26-452 % similar Dimethylformamide diethylacetal1188-33-648 % similar N,N-Dimethylformamide di-tert-butyl acetal36805-97-746 % similar 1,1-Dipropoxytrimethylamine6006-65-144 % similar 1,1-Dibutoxy-N,N-dimethylmethanamine18503-90-741 % similar Dimethylformamide dimethyl acetal4637-24-539 % similar N,N-Dimethyl-1,1-bis(phenylmethoxy)methanamine2016-04-837 % similar N,N-Dimethyl-1,1-bis(1-methylethoxy)methanamine18503-89-436 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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