N'-(4-chlorobenzoyl)-1-benzofuran-2-carbohydrazide
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Basic information
- CAS
593239-97-5- Standard SMILES
O=C(NNC(=O)c1cc2ccccc2o1)c1ccc(Cl)cc1- InChIKey
MZBGIPKMNSYCOA-UHFFFAOYSA-N- Molecular formula
- C16H11ClN2O3
- Average molar mass
- 314.72 g/mol
- Monoisotopic mass
- 314.0458199
Names & identifiers
- Preferred name
- N'-(4-chlorobenzoyl)-1-benzofuran-2-carbohydrazide
- IUPAC
- N'-(4-chlorobenzoyl)-1-benzofuran-2-carbohydrazide
- English name
- 2-Benzofurancarboxylicacid,2-(4-chlorobenzoyl)hydrazide(9CI)
- Molecular formula
- C16H11ClN2O3
- Molecular weight
- 314.72
Names & synonyms
593239-97-5N'-(4-chlorobenzoyl)benzofuran-2-carbohydrazideN'-(4-chlorobenzoyl)-1-benzofuran-2-carbohydrazideMLS000769457CHEMBL1340635DTXSID701324028HMS2801I18STK129745AKOS003210623SMR000434170DB-3237324-Chloro-benzoic acid N'-(benzofuran-2-carbonyl)-hydrazide
Show more names
2-Benzofurancarboxylicacid,2-(4-chlorobenzoyl)hydrazide(9CI)
N'-[(4-chlorophenyl)carbonyl]-1-benzofuran-2-carbohydrazide2-BENZOFURANCARBOXYLIC ACID, 2-(4-CHLOROBENZOYL)HYDRAZIDE
Database identifiers
- CAS
593239-97-5- PubChem CID
- 930590
- DTXSID
DTXSID701324028- ChEMBL
CHEMBL1340635
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 424
Experimental & physicochemical properties
Solubility0.5 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 575.6 · 575.6±46.0 °C(Predicted)
- Density
- 1.387 · 1.387±0.06 g/cm3(Predicted)
- pka
- 10.21 · 10.21±0.23(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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