Grundinformationen
- Standard-SMILES
CCN(CC)c1ccc(N=Nc2ccccc2)cc1- InChIKey
SJJISKLXUJVZOA-UHFFFAOYSA-N- Summenformel
- C16H19N3
- Durchschnittliche Molmasse
- 253,34 g/mol
- Monoisotopische Masse
- 253,15789761
Überblick
Solvent yellow 56 is an azobenzene that is N,N-diethylaniline substituted at position 4 by a phenylazo group. It has a role as a mutagen and a dye. It is a member of azobenzenes, a substituted aniline and a tertiary amino compound.
Namen und Bezeichner
- Bevorzugter Name
- Solvent Yellow 56
- IUPAC
- N,N-diethyl-4-phenyldiazenylaniline
- Lokaler Name
- N,N-Diethyl-p-(phenylazo)anilin
- Englischer Name
- Solvent Yellow 56
- Summenformel
- C16H19N3
- Molmasse
- 253.34
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
2481-94-9、87986-73-0- PubChem CID
- 17204
- DTXSID
DTXSID8041745- ChEMBL
CHEMBL3561103- ChEBI
CHEBI:91087- UNII
- 5E973680S8
- EC Number
- 219-616-8
- Nikkaji
- J2.157A、J426.494K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,3
- Polarare Oberfläche (TPSA)
- 28 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 259
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 94 · 94-96°C
- Siedepunkt
- 386.54 °C · 386.54°C (rough estimate)
- Dichte
- 1.0901 · 1.0901 (rough estimate)
- Dampfdruck
- 0 Pa · 0Pa at 25℃
- Brechungsindex
- 1.647 · 1.6470 (estimate)
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- Chloroform (Sparingly), DMSO (Slightly, Sonicated)
- pka
- 3.41 · 3.41±0.50(Predicted)
- Aggregatzustand
- A solid
- Farbe
- Dark Orange to Very Dark Orange
- Wasserlöslichkeit
- 264 μg/L · 264μg/L at 25℃
- LogP
- 5.27 · 5.27
- CAS Datenbank
- 2481 · 2481-94-9(CAS DataBase Reference)
- EPA chemische Informationen
- 56 · C.I. Solvent Yellow 56 (2481-94-9)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 4.3% (9 of 210) of reports.
Warning
H302 (76.2%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 210 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Benzenamine, N,N-diethyl-4-(phenylazo)-
REACH registered substance: N,N-diethyl-p-(phenylazo)aniline (EC: 219-616-8)
Benzenamine, N,N-diethyl-4-(phenylazo)-: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- tsca
- TSCA listed
- hs_code
- 29299090
- RTECS-Nr.
- CX9871000
- risk_code
- 20/21/22-36/37/38-68
- Toxizität
- mma-sat 1 mg/plate EPASR* 8EHQ-0982-0455
- safety_code
- 26-36/37/39-60-36/37
Chemie und Industrie
Verwendung und Herstellung
Darstellung
synthetischeaniline diazotization, and N,N-diethylbenzenamine coupling.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Ergänzende Hinweise
DefinitionChEBI: An azobenzene that is N,N-diethylaniline substituted at position 4 by a phenylazo group.
Zugehörige Reaktionen
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Verknüpfte Notizen
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