Basic information
- CAS
19933-51-8- Standard SMILES
Nc1nc(-c2ccccc2)c(-c2ccccc2)n1N- InChIKey
WXQOHYIZALVTPS-UHFFFAOYSA-N- Molecular formula
- C15H14N4
- Average molar mass
- 250.3 g/mol
- Monoisotopic mass
- 250.12184646
Names & identifiers
- Preferred name
- 4,5-Diphenylimidazole-1,2-diamine
- IUPAC
- 4,5-diphenylimidazole-1,2-diamine
- English name
- 4,5-DIPHENYL-IMIDAZOLE-1,2-DIAMINE
- Molecular formula
- C15H14N4
- Molecular weight
- 250.3
Names & synonyms
19933-51-84,5-diphenylimidazole-1,2-diamineDTXSID50358700RefChem:285573DTXCID303097554,5-diphenyl-1H-imidazole-1,2-diaminediphenyl-1H-imidazole-1,2-diamineMFCD007702611H-Imidazole-1,2-diamine, 4,5-diphenyl-CBMicro_024101MixCom6_001125Oprea1_278418
Show more names
4,5-DIPHENYL-IMIDAZOLE-1,2-DIAMINE
Oprea1_607046MLS001163925SCHEMBL5924194CHEMBL1611924HMS2868M161,2-diamino-4,5-diphenylimidazoleALBB-030342CCG-11282
Database identifiers
- CAS
19933-51-8- PubChem CID
- 910784
- DTXSID
DTXSID50358700- ChEMBL
CHEMBL1611924
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 69.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 284
Experimental & physicochemical properties
Solubility25.7 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 227 · 227-228 °C
- Boiling point
- 487.9 · 487.9±48.0 °C(Predicted)
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- pka
- 5.1 · 5.10±0.10(Predicted)
Chemistry & industry
Suppliers1 total
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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