4-[(4-Chlorophenyl)hydrazinylidene]pyrazole-3,5-diamine
Basic information
- CAS
5583-76-6- Standard SMILES
Nc1n[nH]c(N)c1N=Nc1ccc(Cl)cc1- InChIKey
AFJGGVKGGIUNFB-UHFFFAOYSA-N- Molecular formula
- C9H9ClN6
- Average molar mass
- 236.66 g/mol
- Monoisotopic mass
- 236.057722
Overview
4-[(4-chlorophenyl)hydrazinylidene]pyrazole-3,5-diamine is a member of phenylhydrazines.
Names & identifiers
- Preferred name
- 4-[(4-Chlorophenyl)hydrazinylidene]pyrazole-3,5-diamine
- IUPAC
- 4-[(4-chlorophenyl)diazenyl]-1H-pyrazole-3,5-diamine
- English name
- 4-[(4-Chlorophenyl)hydrazinylidene]pyrazole-3,5-diamine
- Molecular weight
- 265.71
Names & synonyms
4-[(4-chlorophenyl)hydrazinylidene]pyrazole-3,5-diamineMLS0005676185583-76-64-[(4-chlorophenyl)diazenyl]-1H-pyrazole-3,5-diamineSMR0001779284-[(4-Chloro-phenyl)-hydrazono]-5-imino-4,5-dihydro-1H-pyrazol-3-ylamine4-((4-chlorophenyl)diazenyl)-1h-pyrazole-3,5-diamineCBMicro_025538SCHEMBL923504SCHEMBL3836615CHEMBL1559011SCHEMBL26512362
Show more names
2-(ETHYLSULFONYL)-N,N-DIMETHYLETHANAMINE PERCHLORATEEthanamine, 2-(ethylsulfonyl)-N,N-dimethyl-, perchlorate (1:1)
BDBM59939cid_5287037DTXSID40415316CHEBI:117109HMS1677K03HMS2582G21CCG-12524STK673960
Database identifiers
- CAS
5583-76-6- PubChem CID
- 694053
- DTXSID
DTXSID40415316- ChEMBL
CHEMBL1559011- ChEBI
CHEBI:117109- Nikkaji
- J497.076D
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- Melting point
- 92 · 92-93 °C
Chemistry & industry
Additional notes
DefinitionChEBI: 4-[(4-chlorophenyl)hydrazinylidene]pyrazole-3,5-diamine is a member of phenylhydrazines.
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Related reactions
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Compound notes
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