2',6'-Butyroxylidide, 2-(diethylamino)-, hydrochloride
Basic information
- CAS
58345-48-5- Standard SMILES
CCC(C(=O)Nc1c(C)cccc1C)[NH+](CC)CC.[Cl-]- InChIKey
ZKVDZTJLEAYWEW-UHFFFAOYSA-N- Molecular formula
- C16H27ClN2O
- Average molar mass
- 298.8 g/mol
- Monoisotopic mass
- 298.1811912
Names & identifiers
- Preferred name
- 2',6'-Butyroxylidide, 2-(diethylamino)-, hydrochloride
- IUPAC
- [1-(2,6-dimethylanilino)-1-oxobutan-2-yl]-diethylazanium chloride
Names & synonyms
58345-48-52',6'-BUTYROXYLIDIDE, 2-(DIETHYLAMINO)-, HYDROCHLORIDERefChem:10586102-(Diethylamino)-2',6'-butyroxylidide hydrochloride
Database identifiers
- CAS
58345-48-5- PubChem CID
- 42733
Properties
Computed structural properties
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 266
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Compound notes
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