chempirical

1-Amino-3,3-diethoxypropane

C7H17NO2CAS 41365-75-7147.22 g/mol

Open in Covalent MOL file
OH2NO
AcetalEtherPrimary amine

Properties

Molecular formula
C7H17NO2
Molar mass
147.22 g/mol
Exact mass
147.1259 Da
logP
0.73Crippen estimate
Polar surface area
44.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
6

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
41365-75-7
SMILES
CCOC(CCN)OCC
InChIKey
PXXMSHBZYAOHBD-UHFFFAOYSA-N
InChI
InChI=1S/C7H17NO2/c1-3-9-7(5-6-8)10-4-2/h7H,3-6,8H2,1-2H3

Weigh it out

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

Work with 1-Amino-3,3-diethoxypropane

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

4,4-Diethoxy-1-butanamine6346-09-474 % similar 1,3-Dioxolane-2-ethanamine5754-35-859 % similar Aminoacetaldehyde diethylacetal645-36-357 % similar 3-Chloro-1,1-diethoxypropane35573-93-452 % similar 1,1,3-Triethoxypropane7789-92-652 % similar 1,1,3,3-Tetraethoxypropane122-31-650 % similar 1,1-Diethoxyhexane3658-93-350 % similar 4-Chlorobutyraldehyde diethyl acetal6139-83-948 % similar

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

Same formula

Dimethylformamide diethylacetal1188-33-6 (S)-3-(tert-Butylamino)propane-1,2-diol30315-46-9 3-(Diethylamino)-1,2-propanediol621-56-7

Elsewhere

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