Basic information
- CAS
34319-22-7- Standard SMILES
COc1ccc(NC(=O)c2oc3ccccc3c2C)cc1- InChIKey
JXMSJEIXLQENFY-UHFFFAOYSA-N- Molecular formula
- C17H15NO3
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.10519334
Names & identifiers
- Preferred name
- 2-Benzofurancarboxamide, N-(p-methoxyphenyl)-3-methyl-
- IUPAC
- N-(4-methoxyphenyl)-3-methyl-1-benzofuran-2-carboxamide
- English name
- N-(p-Methoxyphenyl)-3-methyl-2-benzofurancarboxamide
- Molecular formula
- C17H15NO3
- Molecular weight
- 281.31
Names & synonyms
34319-22-7S2ZFQ9R1ML2-BENZOFURANCARBOXAMIDE, N-(p-METHOXYPHENYL)-3-METHYL-N-p-Anisyl-3-methylbenzofuran-2-carboxamideUNII-S2ZFQ9R1MLN-(4-Methoxyphenyl)-3-methyl-2-benzofurancarboxamideDTXSID80187883RefChem:85554DTXCID40110374N-(4-methoxyphenyl)-3-methyl-1-benzofuran-2-carboxamideN-(p-Methoxyphenyl)-3-methyl-2-benzofurancarboxamideBAS 03303118
Show more names
2-Benzofurancarboxamide, N-(4-methoxyphenyl)-3-methyl-
F1701-0006N-(4-methoxyphenyl)-3-methylbenzofuran-2-carboxamideSTK865728AKOS000527852CCG-279301ST45248356ST50016581SR-01000364390
Database identifiers
- CAS
34319-22-7- PubChem CID
- 36746
- DTXSID
DTXSID80187883- UNII
- S2ZFQ9R1ML
- Nikkaji
- J76.270I
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 51.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 365
Physicochemical properties
- Boiling point
- 375.6 · 375.6±37.0 °C(Predicted)
- Density
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- pka
- 12.36 · 12.36±0.70(Predicted)
- FDA UNII
- 2 ZFQ9R1ML · S2ZFQ9R1ML
Chemistry & industry
Suppliers1 total
OTAVA-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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