Basic information
- CAS
17473-76-6- Standard SMILES
O=C(NNc1ccc(Cl)cc1)c1ccccc1- InChIKey
JQDUOCCITWQNES-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2O
- Average molar mass
- 246.69 g/mol
- Monoisotopic mass
- 246.0559907
Names & identifiers
- Preferred name
- Benzoic acid, 2-(p-chlorophenyl)hydrazide
- IUPAC
- N'-(4-chlorophenyl)benzohydrazide
- English name
- 2-(4-Chlorophenyl)hydrazidebenzoicacid
- Molecular formula
- C13H11ClN2O
- Molecular weight
- 246.69
Names & synonyms
BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDEBenzoic (p-chlorophenyl)hydrazideBRN 0653306Benzoic acid, 2-(4-chlorophenyl)hydrazideDTXSID10169894RefChem:326807DTXCID90923850-15-00-00428 (Beilstein Handbook Reference)N'-(4-chlorophenyl)benzohydrazide17473-76-6CHEMBL347267BDBM50086489
Show more names
AKOS000279615Benzoic acid N''-(4-chloro-phenyl)-hydrazideSR-01000029130SR-01000029130-1
Database identifiers
- CAS
17473-76-6- PubChem CID
- 28566
- DTXSID
DTXSID10169894- ChEMBL
CHEMBL347267- Nikkaji
- J436.496A
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- Melting point
- 151 · 151-151.5 °C(Solv: benzene (71-43-2))
- Boiling point
- 342.1 · 342.1±25.0 °C(Predicted)
- Density
- 1.304 · 1.304±0.06 g/cm3(Predicted)
- pka
- 11.81 · 11.81±0.23(Predicted)
Chemistry & industry
Suppliers1 total
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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