Aminoacetaldehyde diethylacetal
Properties
- Molecular formula
- C6H15NO2
- Molar mass
- 133.19 g/mol
- Exact mass
- 133.1103 Da
- Density
- 0.9152 g/mL (at 25 °C)
- Melting point
- −78 °C
- Boiling point
- 163 °C
- logP
- 0.34Crippen estimate
- Polar surface area
- 44.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 5
Hazards
Danger
- H226 Flammable liquid and vapor100% of notifiers
- H314 Causes severe skin burns and eye damage26.4% of notifiers
- H315 Causes skin irritation73.6% of notifiers
- H318 Causes serious eye damage17% of notifiers
- H319 Causes serious eye irritation73.6% of notifiers
- H335 May cause respiratory irritation73.6% of notifiers
Aggregated from 53 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
645-36-3SMILES
CCOC(CN)OCCInChIKey
HJKLEAOXCZIMPI-UHFFFAOYSA-NInChI
InChI=1S/C6H15NO2/c1-3-8-6(5-7)9-4-2/h6H,3-5,7H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
14 names · show all
- Ethanamine, 2,2-diethoxy-
- Acetaldehyde, amino-, diethyl acetal
- 2,2-Diethoxyethanamine
- 2,2-Diethoxyethylamine
- Glycinaldehyde diethyl acetal
- Aminoacetaldehyde diethyl acetal
- 2-Aminoacetaldehyde diethyl acetal
- α-Aminoacetaldehyde diethyl acetal
- 1-Amino-2,2-diethoxyethane
- β,β-Diethoxyethylamine
- 1,1-Diethoxy-2-aminoethane
- NSC 19501
- 2,2-Bis(ethyloxy)ethanamine
- 2,2-Diethoxyethan-1-amine
Reactions
Work with Aminoacetaldehyde diethylacetal
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
1,1,3,3-Tetraethoxypropane122-31-655 % similar
4,4-Diethoxy-1-butanamine6346-09-452 % similar
2-Chloro-1,1-diethoxyethane621-62-548 % similar
2,2-Diethoxyethanol621-63-648 % similar
Aminoacetaldehyde dimethyl acetal22483-09-645 % similar
3-Chloro-1,1-diethoxypropane35573-93-444 % similar
2,2-Diethoxy-N,N-dimethylethanamine3616-56-644 % similar
1,1,3-Triethoxypropane7789-92-644 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds