2-Ethoxy-N,N-diethylbenzamide
Basic information
- CAS
3688-82-2- Standard SMILES
CCOc1ccccc1C(=O)N(CC)CC- InChIKey
LEBSHMYVTNMJNP-UHFFFAOYSA-N- Molecular formula
- C13H19NO2
- Average molar mass
- 221.29 g/mol
- Monoisotopic mass
- 221.14157885
Names & identifiers
- Preferred name
- 2-Ethoxy-N,N-diethylbenzamide
- IUPAC
- 2-ethoxy-N,N-diethylbenzamide
- English name
- 2-Ethoxy-N,N-diethylbenzamide
- Molecular formula
- C13H19NO2
- Molecular weight
- 221.3
Names & synonyms
2-Ethoxy-N,N-diethylbenzamide3688-82-2Benzamide, 2-ethoxy-N,N-diethyl-NSC7152AI3-20297Ortho-ethoxydiethylbenzamideSCHEMBL10381438DTXSID701903612-Ethoxy-N,N-diethylbenzamide #LEBSHMYVTNMJNP-UHFFFAOYSA-NNSC 7152NSC-7152
Show more names
N,N-Diethyl-2-ethoxybenzamide
AKOS003847265
Database identifiers
- CAS
3688-82-2- PubChem CID
- 77268
- DTXSID
DTXSID70190361- Nikkaji
- J419.211G
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 214
Experimental & physicochemical properties
LogP2.5
Physicochemical properties
- Boiling point
- 115 °C · 115 °C(Press: 0.1 Torr)
- Density
- 1.013 · 1.013±0.06 g/cm3(Predicted)
- pka
- -0.78 · -0.78±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…