Grundinformationen
- CAS
3087-39-6- Standard-SMILES
CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].[Ti+4]- InChIKey
GRWPYGBKJYICOO-UHFFFAOYSA-N- Summenformel
- C16H36O4Ti
- Durchschnittliche Molmasse
- 340,32 g/mol
- Monoisotopische Masse
- 340,2093003
Namen und Bezeichner
- Bevorzugter Name
- Titanum tetra t-butoxide
- IUPAC
- tetrakis(2-methylpropan-2-olate);titanium(4+)
- Lokaler Name
- Titan(4+)-2-methylpropan-2-olat
- Englischer Name
- Tetra-tert-butyl orthotitanate
- Summenformel
- C16H36O4Ti
- Molmasse
- 340.32
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
3087-39-6- PubChem CID
- 6451515
- DTXSID
DTXSID70890571- UNII
- PX6YR1S99S
- EC Number
- 221-412-9
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 92,2 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 21
- Formalladung
- 0
- Komplexität
- 25
Experimentelle und physikochemische Eigenschaften
Physical Description
CBI
Colorless liquid with a sweet odor; [Strem Chemicals MSDS]
Physikochemische Eigenschaften
- Siedepunkt
- 70 °C · 70 °C (2 mmHg)
- Dichte
- 0.881 g/mL · 0.881 g/mL at 25 °C(lit.)
- Dampfdruck
- 43 hPa · 43 hPa ( 136 °C)
- Brechungsindex
- 20 · n20/D 1.438
- Flammpunkt
- 47 °C · 47°C
- storage temp.
- 30 °C · Store below +30°C.
- Aggregatzustand
- Liquid
- Wichte
- 0.89 · 0.89
- Farbe
- Clear colorless
- BRN
- 3681801 · 3681801
- InChI
- InChI=1S/4C4H9O.Ti/c4*1-4(2,3)5;/h4*1-3H3;/q4*-1;+4
- InChIKey
- GRWPYGBKJYICOO-UHFFFAOYSA-N
- SMILES
- [Ti](OC(C)(C)C)(OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C
- LogP
- 2.84 at · 2.84 at 25℃
- EPA chemische Informationen
- 2 · 2-Propanol, 2-methyl-, titanium(4+) salt (4:1) (3087-39-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H315 (90.5%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (60.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 84 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;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
2-Propanol, 2-methyl-, titanium(4+) salt (4:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propanol, 2-methyl-, titanium(4+) salt (4:1) 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 12-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/26708
Titanium(4+) 2-methylpropan-2-olate: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Reacts with water forming titanium dioxide and t-butanol; An irritant; Inhalation may cause headache, dizziness, and drowsiness; [Strem Chemicals MSDS] See Titanium dioxide and tert-Butyl alcohol. See Potassium tert-butoxide and Zirconium(IV) butoxide.
Regulatorische Informationen
Regulatory Information
2-Propanol, 2-methyl-, titanium(4+) salt (4:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propanol, 2-methyl-, titanium(4+) salt (4:1) 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 12-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/26708
Titanium(4+) 2-methylpropan-2-olate: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- F
- 10-21
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1993 3/PG 3
- hs_code
- 29319090
- risk_code
- 10-36/37/38
- hazard_code
- Xi
- safety_code
- 16-26-36
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 3
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
Petrochemical Manufacturing
2-Propanol, 2-methyl-, titanium(4+) salt (4:1): ACTIVE
Anwendungen
Verwendentert-Butoxytitanium (IV) is used in the preparation of moisture-curable modified polysiloxane and silicone rubber.
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