Grundinformationen
- Standard-SMILES
OC(c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
LZTRCELOJRDYMQ-UHFFFAOYSA-N- Summenformel
- C19H16O
- Durchschnittliche Molmasse
- 260,3 g/mol
- Monoisotopische Masse
- 260,12011513
Überblick
Tritylalcohol is a benzenoid aromatic compound.
Namen und Bezeichner
- Bevorzugter Name
- Triphenylcarbinol
- IUPAC
- triphenylmethanol
- Lokaler Name
- Triphenylmethanol
- Englischer Name
- Triphenylmethanol
- Summenformel
- C19H16O
- Molmasse
- 260.33
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
76-84-6- PubChem CID
- 6457
- DTXSID
DTXSID0058803- ChEMBL
CHEMBL118166- ChEBI
CHEBI:228440- UNII
- U97Q0OU9KB
- EC Number
- 200-988-5
- Nikkaji
- J4.186F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,7
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 235
Experimentelle und physikochemische Eigenschaften
Physical Description
Other Solid
Solid; [Merck Index] White to cream crystalline powder; [Alfa Aesar MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 160 · 160-163 °C (lit.)
- Siedepunkt
- 360 °C · 360 °C (lit.)
- Dichte
- 40 · d40 1.199
- Brechungsindex
- 1.622 · 1.6220 (estimate)
- Flammpunkt
- 360 · 360-380°C
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- 0.1 g/mL, · dioxane: 0.1 g/mL, clear
- pka
- 12.73 · 12.73±0.29(Predicted)
- Aggregatzustand
- Fine Crystalline Powder
- Farbe
- White to light yellow
- Wasserlöslichkeit
- INSOLUBLE
- Merck
- 14 · 14,9739
- BRN
- 1460837 · 1460837
- Stabilität
- Stable. Combustible. Incompatible with oxidizing agents, acids, acid chlorides, acid anhydrides.
- InChI
- 1S/C19H16O/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,20H
- InChIKey
- LZTRCELOJRDYMQ-UHFFFAOYSA-N
- SMILES
- OC(c1ccccc1)(c2ccccc2)c3ccccc3
- CAS Datenbank
- 76 · 76-84-6(CAS DataBase Reference)
- NIST chemische Informationen
- Benzenemethanol, «alpha»,«alpha»-diphenyl-(76-84-6)
- EPA chemische Informationen
- Benzenemethanol, .alpha.,.alpha.-diphenyl- (76-84-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 0.9% (1 of 114) of reports.
Warning
H315 (98.2%): 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 114 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Benzenemethanol, .alpha.,.alpha.-diphenyl-
Benzenemethanol, .alpha.,.alpha.-diphenyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenemethanol, .alpha.,.alpha.-diphenyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 14-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/21505
Benzenemethanol, .alpha.,.alpha.-diphenyl-: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29062900
- risk_code
- 38-36/37/38
- hazard_code
- Xi
- safety_code
- 22-24/25-36-26
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
Petrochemical Manufacturing
Benzenemethanol, .alpha.,.alpha.-diphenyl-: ACTIVE
Anwendungen
VerwendenTriphenylmethanol is used as a reagent in the research laboratory. It acts as an intermediate in the production of the commercially useful triarylmethane dyes. It is used in the preparation of triphenylmethane. It is also used as an antiproliferative agent. Further, it is used in the preparation of two-electron reduction product of pyrylogen. In addition to this, it reacts with triphenylphosphine oxide to form a 1:1 molecular complex. It serves as a specific clathrate host for methanol and dimethyl sulphoxide and forms clathrate inclusion complexes. Triphenylmethanol was used in the synthesis of of the two-electron reduction product of pyrylogen. It undergoes reduction to triphenylmethane by 9, 10-dihydro-10-methylacridine in the presence of perchloric acid.
Darstellung
synthetischeTriphenylmethanol synthesis: Triphenylmethanol was prepared by the action of benzene with carbon tetrachloride in the presence of Aluminum chloride, followed by acidification and hydrolysis.Triphenylmethanol can also be prepared by the reaction of phenylmagnesium bromide with methyl benzoate (instead of benzophenone).Synthesis of Triphenylmethanol
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