2-(2-Propan-2-yl-1,3-dioxolan-2-yl)ethanamine
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Basic information
- CAS
81835-65-6- Standard SMILES
CC(C)C1(CCN)OCCO1- InChIKey
WHAPULSACGMUTL-UHFFFAOYSA-N- Molecular formula
- C8H17NO2
- Average molar mass
- 159.23 g/mol
Names & identifiers
- Preferred name
- 2-(2-Propan-2-yl-1,3-dioxolan-2-yl)ethanamine
- IUPAC
- 2-(2-propan-2-yl-1,3-dioxolan-2-yl)ethanamine
- English name
- 1,3-Dioxolane-2-ethanamine,2-(1-methylethyl)-(9CI)
- Molecular formula
- C8H17NO2
- Molecular weight
- 159.23
Names & synonyms
1-amino-4-methyl-3-pentanone ethylene acetal2-(2-isopropyl-1,3-dioxolan-2-yl)ethan-1-amine1,3-Dioxolane-2-ethanamine,2-(1-methylethyl)-(9CI)
Database identifiers
- CAS
81835-65-6
Properties
Computed structural propertiesFilling in
- XLogP
- 0.4
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 119
Physicochemical properties
- Boiling point
- 212.833 · 212.833±15.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.979 · 0.979±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.329 · 10.329±0.10(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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