Ethanone, 1-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-, hydrochloride
Basic information
- CAS
2970-80-1- Standard SMILES
CN(C)CC(=O)c1ccc2c(c1)OCO2.Cl- InChIKey
FEEQAAASFSUHRC-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO3
- Average molar mass
- 243.68 g/mol
- Monoisotopic mass
- 243.066221
Names & identifiers
- Preferred name
- Ethanone, 1-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-, hydrochloride
- IUPAC
- 1-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethanone;hydrochloride
Names & synonyms
1-(1,3-Benzodioxol-5-yl)-2-(dimethylamino)ethanone hydrochlorideEthanone, 1-(1,3-benzodioxol-5-yl)-2-(dimethylamino)-, hydrochloride2970-80-1DTXSID20183849RefChem:340991DTXCID101063401-(2H-1,3-Benzodioxol-5-yl)-2-(dimethylamino)ethan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
2970-80-1- PubChem CID
- 200948
- DTXSID
DTXSID20183849
Properties
Computed structural properties
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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