Basic information
- CAS
25939-13-3- Standard SMILES
O=[N+]([O-])c1ccc(NN=C(Cl)c2ccccc2)cc1- InChIKey
JFDRODAOMXUGGM-UHFFFAOYSA-N- Molecular formula
- C13H10ClN3O2
- Average molar mass
- 275.69 g/mol
- Monoisotopic mass
- 275.0461543
Names & identifiers
- Preferred name
- N-(4-Nitrophenyl)benzenecarbohydrazonoyl chloride
- IUPAC
- N-(4-nitrophenyl)benzenecarbohydrazonoyl chloride
- English name
- N-(4-Nitrophenyl)benzenecarbohydrazonoylchloride
- Molecular formula
- C13H10ClN3O2
- Molecular weight
- 275.69
Names & synonyms
N-(4-Nitrophenyl)benzenecarbohydrazonoyl chlorideDTXSID301231124benzoyl chloride 4-nitrophenyl-hydrazoneBenzoyl chloride (p-nitrophenyl)hydrazoneN-(4-Nitrophenyl)benzenecarbohydrazonoylchloride1-(α-Chlorobenzylidene)-2-(4-nitrophenyl)hydrazine1-(4-Nitrophenyl)-2-(α-chlorobenzylidene)hydrazineBenzenecarbohydrazonoyl chloride, N-(4-nitrophenyl)-1-(Chlorophenylmethylene)-2-(4-nitrophenyl)hydrazineamino-[chloro(phenyl)methylidene]-(4-nitrophenyl)ammonium
Database identifiers
- CAS
25939-13-3- PubChem CID
- 33248
- DTXSID
DTXSID301231124
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
Physicochemical properties
- Melting point
- 191 · 191-191.5 °C
- Boiling point
- 423.6 · 423.6±47.0 °C(Predicted)
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- pka
- 13.73 · 13.73±0.10(Predicted)
Chemistry & industry
Suppliers4 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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