Basic information
- CAS
2906-67-4- Standard SMILES
CC[NH2+]CCOc1cccc2c1OCCO2.[Cl-]- InChIKey
LHLZCOPOMALZJE-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO3
- Average molar mass
- 259.73 g/mol
- Monoisotopic mass
- 259.0975211
Names & identifiers
- Preferred name
- Diethylamine, 2-(1,4-benzodioxan-5-yloxy)-, hydrochloride
- IUPAC
- 2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl-ethylazanium chloride
Names & synonyms
2-(1,4-Benzodioxan-5-yloxy)diethylamine hydrochloride2906-67-4DIETHYLAMINE, 2-(1,4-BENZODIOXAN-5-YLOXY)-, HYDROCHLORIDERefChem:338126P-33
Database identifiers
- CAS
2906-67-4- PubChem CID
- 17951
Properties
Computed structural properties
- Topological polar surface area
- 44.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 201
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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