N-(5-Amino-2-methoxyphenyl)-2-furamide
Basic information
- CAS
402599-21-7- Standard SMILES
COc1ccc(N)cc1NC(=O)c1ccco1- InChIKey
YCNHDBQRHMUSOJ-UHFFFAOYSA-N- Molecular formula
- C12H12N2O3
- Average molar mass
- 232.23 g/mol
- Monoisotopic mass
- 232.08479225
Names & identifiers
- Preferred name
- N-(5-Amino-2-methoxyphenyl)-2-furamide
- IUPAC
- N-(5-amino-2-methoxyphenyl)furan-2-carboxamide
- English name
- CHEMBRDG-BB 6094035
- Molecular formula
- C12H12N2O3
- Molecular weight
- 232.24
Names & synonyms
402599-21-7N-(5-AMINO-2-METHOXYPHENYL)-2-FURAMIDEN-(5-amino-2-methoxyphenyl)furan-2-carboxamideMFCD02031883DTXSID80586170CHEMBRDG-BB 6094035STK292516AKOS000127376BS-37828CS-0327434F314801N-(5-amino-2-methoxy-phenyl)furan-2-carboxamide
Show more names
AKOS BBV-007365UKRORGSYN-BB BBV-0073652-Furancarboxamide, N-(5-amino-2-methoxyphenyl)-N-(5-amino-2-methoxyphenyl)-2-furamide(SALTDATA: FREE)
Database identifiers
- CAS
402599-21-7- PubChem CID
- 16490752
- DTXSID
DTXSID80586170
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Boiling point
- 321 · 321.0±37.0 °C(Predicted)
- Density
- 1.309 · 1.309±0.06 g/cm3(Predicted)
- pka
- 11.97 · 11.97±0.70(Predicted)
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_code
- Xi
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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