Basic information
- CAS
50341-80-5- Standard SMILES
CCCCN(CCN(CC)CC)C(=O)c1cc2ccccc2o1- InChIKey
CSZIMDXHTMNLDI-UHFFFAOYSA-N- Molecular formula
- C19H28N2O2
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.21507814
Names & identifiers
- Preferred name
- 2-Benzofurancarboxamide, N-butyl-N-(2-(diethylamino)ethyl)-
- IUPAC
- N-butyl-N-[2-(diethylamino)ethyl]-1-benzofuran-2-carboxamide
- English name
- N-Butyl-N-[2-(diethylamino)ethyl]-2-benzofurancarboxamide
- Molecular formula
- C19H28N2O2
- Molecular weight
- 316.44
Names & synonyms
50341-80-5BRN 1388588N-Butyl-N-(2-(diethylamino)ethyl)-2-benzofurancarboxamide2-BENZOFURANCARBOXAMIDE, N-BUTYL-N-(2-(DIETHYLAMINO)ETHYL)-N-Butyl-N-[2-(diethylamino)ethyl]-2-benzofurancarboxamideRefChem:256337DTXSID90964627N-Butyl-N-[2-(diethylamino)ethyl]-1-benzofuran-2-carboxamideDB-266122N-butyl-N-[2-(diethylamino)ethyl ]-2-benzofurancarboxamide2-Benzofurancarboxamide, N-butyl-N-[2-(diethylamino)ethyl]-
Database identifiers
- CAS
50341-80-5- PubChem CID
- 39650
- DTXSID
DTXSID90964627- Nikkaji
- J71.501H
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 357
Physicochemical properties
- Boiling point
- 443.2 · 443.2±25.0 °C(Predicted)
- Density
- 1.051 · 1.051±0.06 g/cm3(Predicted)
- pka
- 9.09 · 9.09±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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