Grundinformationen
- Standard-SMILES
c1ccc(C(c2ccccc2)c2ccccc2)cc1- InChIKey
AAAQKTZKLRYKHR-UHFFFAOYSA-N- Summenformel
- C19H16
- Durchschnittliche Molmasse
- 244,3 g/mol
- Monoisotopische Masse
- 244,12520051
Überblick
Triphenylmethane is a triarylmethane in which the three aryl groups are phenyl. It forms the basic skeleton of several synthetic dyes. It has a role as a xenobiotic and an environmental contaminant.
Namen und Bezeichner
- Bevorzugter Name
- Triphenylmethane
- IUPAC
- benzhydrylbenzene
- Lokaler Name
- Triphenylmethan
- Englischer Name
- Triphenylmethane
- Summenformel
- C19H16
- Molmasse
- 244.33
Namen und Synonyme
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Datenbank-Bezeichner
- CAS
519-73-3- PubChem CID
- 10614
- DTXSID
DTXSID3060164- ChEBI
CHEBI:76212- UNII
- 8O4UTW9E17
- EC Number
- 208-275-0
- Nikkaji
- J1.574A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,3
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 0
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 196
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 92 · 92-94 °C(lit.)
- Siedepunkt
- 358 · 358-359 °C754 mm Hg(lit.)
- Dichte
- 1.014 g/mL · 1.014 g/mL at 25 °C(lit.)
- Brechungsindex
- 100 · nD100 1.59546
- Flammpunkt
- 358 · 358-359°C
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- 0.1 g/mL, · dioxane: 0.1 g/mL, clear
- pka
- 31.5 · 31.5(at 25℃)
- Aggregatzustand
- Powder
- Farbe
- Faint yellow
- Wichte
- 1.014 · 1.014
- Wasserlöslichkeit
- INSOLUBLE
- Merck
- 14 · 14,9741
- BRN
- 1909753 · 1909753
- Dielectric constant
- 3.6 · 3.6(65℃)
- Stabilität
- Stable; combustible. Incompatible with strong oxidizing agents.
- InChI
- 1S/C19H16/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H
- InChIKey
- AAAQKTZKLRYKHR-UHFFFAOYSA-N
- SMILES
- c1ccc(cc1)C(c2ccccc2)c3ccccc3
- CAS Datenbank
- 519 · 519-73-3(CAS DataBase Reference)
- NIST chemische Informationen
- Triphenylmethane(519-73-3)
- EPA chemische Informationen
- 1 · Benzene, 1,1',1''-methylidynetris- (519-73-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.
Warning
H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Benzene, 1,1',1''-methylidynetris-
Benzene, 1,1',1''-methylidynetris-: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29029080
- risk_code
- 36/37/38
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 22-24/25-36-26
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenTriphenylmethane is a triarylmethane compound used as the backbone of synthetic dyes. Triphenylmethane has also been shown to inhibit 3-methylcholanthrene-induced neoplastic transformation of 10T1/2 cells.
Darstellung
synthetischeTriphenylmethane can be synthesized by Friedel–Crafts reaction from benzene and chloroform with aluminium chloride catalyst: 3 C6H6 + CHCl3 → Ph3CH + 3 HCl
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Ergänzende Hinweise
DefinitionChEBI: Triphenylmethane is a triarylmethane in which the three aryl groups are phenyl. It forms the basic skeleton of several synthetic dyes. It has a role as a xenobiotic and an environmental contaminant.
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