Basic information
- CAS
1929-89-1- Standard SMILES
O=C(Nc1ccccc1)c1ccco1- InChIKey
XHVDWCKBZSFUDE-UHFFFAOYSA-N- Molecular formula
- C11H9NO2
- Average molar mass
- 187.19 g/mol
- Monoisotopic mass
- 187.06332853
Names & identifiers
- Preferred name
- N-Phenyl-2-furancarboxamide
- IUPAC
- N-phenylfuran-2-carboxamide
- English name
- N-Phenyl-2-furancarboxamide
- Molecular formula
- C11H9NO2
- Molecular weight
- 187.19
Names & synonyms
N-phenyl-2-FurancarboxamideRefChem:830937N-phenylfuran-2-carboxamide1929-89-12-FuranilideN-Phenyl-2-furamide2-Furancarboxamide, N-phenyl-Furan-2-carboxylic acid phenylamidefuranilideN-phenyl furamideNSC31282-furancarboxanilide
Show more names
2-furyl-N-benzamideN-Phenyl-2-furamide #Oprea1_366727Oprea1_617596MLS001211749SCHEMBL883844SCHEMBL2515368SCHEMBL2997673
Database identifiers
- CAS
1929-89-1- PubChem CID
- 220406
- DTXSID
DTXSID4075160- ChEMBL
CHEMBL1568885- EC Number
- 103-481-6
- Nikkaji
- J269.691F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 199
Experimental & physicochemical properties
Solubility>28.1 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 124 °C · 124 °C
- Boiling point
- 217.9 · 217.9±13.0 °C(Predicted)
- Density
- 1.238 · 1.238±0.06 g/cm3(Predicted)
- pka
- 12.9 · 12.90±0.70(Predicted)
- EPA Substance Registry System
- 2 · 2-Furanilide (1929-89-1)
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers3 total
陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
Related reactions
6 records
Compound notes
Loading…