Cyclohexanon-2,4-dinitrophenylhydrazon
Cyclohexanone 2,4-dinitrophenylhydrazone
Grundinformationen
- CAS
1589-62-4- Standard-SMILES
O=[N+]([O-])c1ccc(NN=C2CCCCC2)c([N+](=O)[O-])c1- InChIKey
QLWXZRVOHCYKKK-UHFFFAOYSA-N- Summenformel
- C12H14N4O4
- Durchschnittliche Molmasse
- 278,26 g/mol
- Monoisotopische Masse
- 278,10150493
Namen und Bezeichner
- Bevorzugter Name
- Cyclohexanone 2,4-dinitrophenylhydrazone
- IUPAC
- N-(cyclohexylideneamino)-2,4-dinitroaniline
- Lokaler Name
- Cyclohexanon-2,4-dinitrophenylhydrazon
- Englischer Name
- Cyclohexanone 2,4-dinitrophenylhydrazone
- Summenformel
- C12H14N4O4
- Molmasse
- 278.26
Namen und Synonyme
Cyclohexanone 2,4-dinitrophenylhydrazoneCyclohexanone-2,4-dinitrophenylhydrazoneCyclohexanone, 2-(2,4-dinitrophenyl)hydrazoneCYCLOHEXANONE, (2,4-DINITROPHENYL)HYDRAZONECyclohexanone-2,4-DNPHAI3-16296NSC-6125EINECS 216-458-17529K006GTDTXSID40166538NSC 61252-(2,4-DINITROPHENYL)HYDRAZONE CYCLOHEXANONE
Weitere Namen anzeigen
'LGC' (4005)CYCLOHEXANONE-DNPHCYCLOHEXANONE 2,4-DICyclohexanone-DNPH solutionCYCLOHEXANONE DNPH, 100MG,NEATcyclohexanone-2,4-dnph solutionCYCLOHEXANONE (DNPH DERIVATIVE)Cyclohexanone-DNPH solution,3ppmCyclohexanone-DNPH solution,10ppm
CYCLOHEXANONE 2,4-DINITROPHENYLHYDRAZONE [MI]Cyclohexanone2,4DNPHRefChem:580703DTXCID9089029Cyclohexanone, (2,4dinitrophenyl)hydrazone216-458-11589-62-41-cyclohexylidene-2-(2,4-dinitrophenyl)hydrazine
Datenbank-Bezeichner
- CAS
1589-62-4- PubChem CID
- 74117
- DTXSID
DTXSID40166538- ChEMBL
CHEMBL1892411- UNII
- 7529K006GT
- EC Number
- 216-458-1
- Nikkaji
- J109.739C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2
- Polarare Oberfläche (TPSA)
- 116 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 393
Experimentelle und physikochemische Eigenschaften
Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
Physical DescriptionSlightly brown powder; [Acros Organics MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 158 · 158-160°C
- Siedepunkt
- 421.08 °C · 421.08°C (rough estimate)
- Dichte
- 1.2764 · 1.2764 (rough estimate)
- Brechungsindex
- 1.6081 · 1.6081 (estimate)
- Flammpunkt
- 2 °C · 2 °C
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- 25 mg/mL, · chloroform: 25mg/mL, clear, orange
- Aggregatzustand
- powder or crystals
- pka
- 14.29 · 14.29±0.20(Predicted)
- Wasserlöslichkeit
- Soluble in water (partly).
- Major Application
- diagnostic assay manufacturinghematologyhistology
- InChI
- 1S/C12H14N4O4/c17-15(18)10-6-7-11(12(8-10)16(19)20)14-13-9-4-2-1-3-5-9/h6-8,14H,1-5H2
- InChIKey
- QLWXZRVOHCYKKK-UHFFFAOYSA-N
- SMILES
- [O-][N+](=O)c1ccc(N\N=C2\CCCCC2)c(c1)[N+]([O-])=O
Sicherheit und Regulatorisches
Gefahrenhinweise
Hazards SummaryMay cause irritation; [Acros Organics MSDS]
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN 1648 3/PG 2
- risk_code
- 11-20/21/22-36-39/23/24/25
- hazard_code
- F,T,Xn
- safety_code
- 16-36/37-45
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Anwendungen
VerwendenCyclohexanone 2,4-dinitrophenylhydrazone is a useful standard for elemental analysis. Also used as a pharmaceutical intermediate.
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