Basic information
- CAS
110506-35-9- Standard SMILES
COc1cc(N)ccc1NC(=O)c1ccco1- InChIKey
CMHQZTVPXAZJJR-UHFFFAOYSA-N- Molecular formula
- C12H12N2O3
- Average molar mass
- 232.23 g/mol
- Monoisotopic mass
- 232.08479225
Names & identifiers
- Preferred name
- N-(4-amino-2-methoxyphenyl)furan-2-carboxamide
- IUPAC
- N-(4-amino-2-methoxyphenyl)furan-2-carboxamide
- English name
- FURAN-2-CARBOXYLIC ACID (4-AMINO-2-METHOXY-PHENYL)-AMIDE
- Molecular formula
- C12H12N2O3
- Molecular weight
- 232.24
Names & synonyms
110506-35-9n-(4-amino-2-methoxyphenyl)-2-furamideN-(4-amino-2-methoxyphenyl)furan-2-carboxamideFuran-2-carboxylic acid (4-amino-2-methoxy-phenyl)-amideMFCD022580282-Furancarboxamide, N-(4-amino-2-methoxyphenyl)-furan-2-carboxylic acid(4-amino-2-methoxy-phenyl)-amideN-(4-amino-2-methoxyphenyl)-2-furylcarboxamideTimTec1_006413Oprea1_168464Oprea1_716612DTXSID80353006
Show more names
ZERO/006247BAS 01337763ZINC00157387AKOS BB-8126ASISCHEM T31136CBI-BB ZERO/006247ART-CHEM-BB B025174
CMHQZTVPXAZJJR-UHFFFAOYSA-NHMS1552D11ALBB-024155BBL000075SBB007310STK085706AKOS000108398VS-00429
Database identifiers
- CAS
110506-35-9- PubChem CID
- 736352
- DTXSID
DTXSID80353006
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
- Melting point
- 113 °C · 113 °C(Solv: ethanol (64-17-5))
- Boiling point
- 325.6 · 325.6±37.0 °C(Predicted)
- Density
- 1.309 · 1.309±0.06 g/cm3(Predicted)
- pka
- 11.9 · 11.90±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
Chemistry & industry
Suppliers1 total
湖北扬信医药科技有限公司15347293736 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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