2-Furancarboxamide, 5-formyl-N-(4-methoxyphenyl)-
Basic information
- CAS
685903-99-5- Standard SMILES
COc1ccc(NC(=O)c2ccc(C=O)o2)cc1- InChIKey
OYOPAPMATPYMOT-UHFFFAOYSA-N- Molecular formula
- C13H11NO4
- Average molar mass
- 245.23 g/mol
- Monoisotopic mass
- 245.06880783
Names & identifiers
- Preferred name
- 2-Furancarboxamide, 5-formyl-N-(4-methoxyphenyl)-
- IUPAC
- 5-formyl-N-(4-methoxyphenyl)furan-2-carboxamide
- English name
- 2-Furancarboxamide,5-formyl-N-(4-methoxyphenyl)-(9CI)
- Molecular formula
- C13H11NO4
- Molecular weight
- 245.23
Names & synonyms
SCHEMBL7121858685903-99-5DB-2815432-FURANCARBOXAMIDE, 5-FORMYL-N-(4-METHOXYPHENYL)-2-Furancarboxamide,5-formyl-N-(4-methoxyphenyl)-(9CI)
Database identifiers
- CAS
685903-99-5- PubChem CID
- 45086759
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 299
Physicochemical properties
- Boiling point
- 346.7 · 346.7±37.0 °C(Predicted)
- Density
- 1.313 · 1.313±0.06 g/cm3(Predicted)
- pka
- 10.11 · 10.11±0.70(Predicted)
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Compound notes
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