Grundinformationen
- Standard-SMILES
CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1- InChIKey
BVUXDWXKPROUDO-UHFFFAOYSA-N- Summenformel
- C16H26O
- Durchschnittliche Molmasse
- 234,38 g/mol
- Monoisotopische Masse
- 234,19836545
Namen und Bezeichner
- Bevorzugter Name
- 2,6-Di-tert-butyl-4-ethylphenol
- IUPAC
- 2,6-ditert-butyl-4-ethylphenol
- Lokaler Name
- 2,6-Di-tert-butyl-4-ethylphenol
- Englischer Name
- 2,6-Ditert-butyl-4-ethylphenol
- Summenformel
- C16H26O
- Molmasse
- 234.38
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
4130-42-1- PubChem CID
- 20087
- DTXSID
DTXSID0029262- ChEMBL
CHEMBL225620- ChEBI
CHEBI:177477- UNII
- SV7OZ6J97M
- EC Number
- 223-945-2
- Nikkaji
- J104.299H
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,7
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 17
- Formalladung
- 0
- Komplexität
- 219
Experimentelle und physikochemische Eigenschaften
Physical Description
Dry Powder
Solid
Physikochemische Eigenschaften
- Schmelzpunkt
- 44 °C · >44°C
- Siedepunkt
- 272 °C · 272°C
- Dichte
- 0.926 · 0.9260 (estimate)
- Brechungsindex
- 1.5041 · 1.5041 (estimate)
- Flammpunkt
- 105 °C · 105°C
- storage temp.
- Sealed in dry,Room Temperature
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 12.83 · 12.83±0.40(Predicted)
- Farbe
- White to Light Yellow
- BRN
- 1875693 · 1875693
- LogP
- 5.678 · 5.678 (est)
- CAS Datenbank
- 4130 · 4130-42-1(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · 2,6-Ditert-butyl-4-ethylphenol(4130-42-1)
- EPA chemische Informationen
- 2 · 2,6-Di-tert-butyl-4-ethylphenol (4130-42-1)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 5.6% (1 of 18) of reports.
Warning
H315 (61.1%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (61.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (55.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H400 (33.3%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (33.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard];H411 (27.8%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 18 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 18 reports by companies.;There are 7 notifications provided by 17 of 18 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information
Chemical: Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-
Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl- 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)
Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and Categories
Skin Irrit. 2 (61.1%);Eye Irrit. 2 (61.1%);STOT SE 3 (55.6%);Aquatic Acute 1 (33.3%);Aquatic Chronic 1 (33.3%);Aquatic Chronic 2 (27.8%)
Hazardous to the aquatic environment (Acute) - Category 1;Hazardous to the aquatic environment (Long-term) - Category 1
Toxikologische Informationen
Regulatorische Informationen
Regulatory Information
Chemical: Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-
Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl- 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)
Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- 3077
- hs_code
- 2907.19.2000
- risk_code
- 36/37/38
- safety_code
- 26-36
- hazard_class
- 9
- packing_group
- III
Chemie und Industrie
Pharmakologische Informationen
Verwendung und Herstellung
General Manufacturing Information
Miscellaneous Manufacturing
Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-: ACTIVE
Anwendungen
Verwenden2,6-Di-tert-butyl-4-ethylphenol is used as a catalyst for the synthesis of aromatic carboxamides.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Zugehörige Reaktionen
Verknüpfte Notizen
Wird geladen…