N-(4-cyanophenyl)-4-methoxybenzamide
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Basic information
- CAS
149505-74-8- Standard SMILES
COc1ccc(C(=O)Nc2ccc(C#N)cc2)cc1- InChIKey
PPHGTCXYAXDOSG-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2
- Average molar mass
- 252.27 g/mol
- Monoisotopic mass
- 252.08987763
Names & identifiers
- Preferred name
- N-(4-cyanophenyl)-4-methoxybenzamide
- IUPAC
- N-(4-cyanophenyl)-4-methoxybenzamide
- English name
- N-(4-cyanophenyl)-4-methoxybenzamide
- Molecular formula
- C15H12N2O2
- Molecular weight
- 252.27
Names & synonyms
N-(4-cyanophenyl)-4-methoxybenzamide149505-74-8DTXSID80352498RefChem:361931DTXCID00303563Oprea1_093365Oprea1_285280SCHEMBL6801256STK009439AKOS000188839ST030980N-(4-cyanophenyl)(4-methoxyphenyl)carboxamide
Show more names
Benzamide, 4-cyano-N-(4-methoxyphenyl)-
AN-329/11760452Z30612275
Database identifiers
- CAS
149505-74-8- PubChem CID
- 728098
- DTXSID
DTXSID80352498- Nikkaji
- J1.787.804B
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 344
Physicochemical properties
- Melting point
- 175 · 175-176 °C
- Boiling point
- 365.7 · 365.7±27.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- pka
- 12.24 · 12.24±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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