O-(2-Diethylaminoethyl)-2',6'-mandeloxylidide
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Basic information
- CAS
76678-86-9- Standard SMILES
CCN(CC)CCOC(C(=O)Nc1c(C)cccc1C)c1ccccc1- InChIKey
ALOIIMNXGKZPCE-UHFFFAOYSA-N- Molecular formula
- C22H30N2O2
- Average molar mass
- 354.5 g/mol
- Monoisotopic mass
- 354.2307282
Overview
potent local anesthetic, comparable to tetracaine but more toxic; structure in first source
Names & identifiers
- Preferred name
- O-(2-Diethylaminoethyl)-2',6'-mandeloxylidide
- IUPAC
- 2-[2-(diethylamino)ethoxy]-N-(2,6-dimethylphenyl)-2-phenylacetamide
- English name
- O-(2-diethylaminoethyl)-2',6'-mandeloxylidide
- Molecular formula
- C22H30N2O2
- Molecular weight
- 354.49
Names & synonyms
O-(2-Diethylaminoethyl)-2',6'-mandeloxylidide76678-86-9Benzeneacetamide, alpha-(2-(diethylamino)ethoxy)-N-(2,6-dimethylphenyl)-ODEAE-MXDRefChem:1670782-(2-(Diethylamino)ethoxy)-2-phenyl-2',6'-acetoxylidide2-[2-(diethylamino)ethoxy]-N-(2,6-dimethylphenyl)-2-phenylacetamideDTXSID709979932',6'-ACETOXYLIDIDE, 2-(2-(DIETHYLAMINO)ETHOXY)-2-PHENYL-[2-(Diethylamino)ethoxy]-N-(2,6-dimethylphenyl)(phenyl)ethanimidic acid2-[2-(Diethylamino)ethoxy]-N-(2,6-dimethylphenyl)-2-phenylethanimidic acid
Database identifiers
- CAS
76678-86-9- PubChem CID
- 53525
- DTXSID
DTXSID70997993
Properties
Computed structural propertiesFilling in
- XLogP
- 4.2
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 395
Physicochemical properties
- Melting point
- 68 · 68-69 °C(Solvent: Hexane)
- Boiling point
- 175 °C · 175 °C(Press: 0.03 Torr)
- Density
- 1.077 · 1.077±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.211 · 13.211±0.70(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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