Basic information
- CAS
526196-92-9- Standard SMILES
CCCCc1cc2cc(NC(C)=O)ccc2o1- InChIKey
WVXHYEWVZRKYIB-UHFFFAOYSA-N- Molecular formula
- C14H17NO2
- Average molar mass
- 231.29 g/mol
- Monoisotopic mass
- 231.12592878
Names & identifiers
- Preferred name
- N-(2-Butyl-1-benzofuran-5-yl)acetamide
- IUPAC
- N-(2-butyl-1-benzofuran-5-yl)acetamide
- English name
- N-(2-butylbenzofuran-5-yl)acetaMide
- Molecular formula
- C14H17NO2
- Molecular weight
- 231.29
Names & synonyms
526196-92-9N-(2-Butyl-1-benzofuran-5-yl)acetamideDTXSID80432542RefChem:360538DTXCID50383370N-(2-butylbenzofuran-5-yl)acetamideN-(2-butyl-5-benzofuranyl)acetamideSCHEMBL2561686SCHEMBL30140835WVXHYEWVZRKYIB-UHFFFAOYSA-NAKOS022173349DA-42196
Show more names
2-butyl-5-(acetamide)benzofuran2-Butyl-5-(acetylamino)benzofuran(2-n-butyl-benzofuran-5-yl)-acetamideAcetamide, N-(2-butyl-5-benzofuranyl)-
Database identifiers
- CAS
526196-92-9- PubChem CID
- 9899437
- DTXSID
DTXSID80432542
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Boiling point
- 411.768 · 411.768±25.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.127 · 1.127±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.874 · 14.874±0.43(predicted)
Chemistry & industry
Suppliers2 total
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Related reactions
3 records
Compound notes
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