Grundinformationen
- Standard-SMILES
CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].[Al+3]- InChIKey
WOZZOSDBXABUFO-UHFFFAOYSA-N- Summenformel
- C12H27AlO3
- Durchschnittliche Molmasse
- 246,32 g/mol
- Monoisotopische Masse
- 246,17755835
Überblick
Aluminum butylate is a chemical compound of aluminum. Aluminum is the most abundant metal in the earth's crust and is always found combined with other elements such as oxygen, silicon, and fluorine. (L739, L740)
Namen und Bezeichner
- Bevorzugter Name
- Aluminum sec-butoxide
- IUPAC
- aluminum tris(butan-2-olate)
- Lokaler Name
- Aluminiumtri-sec-butanolat
- Englischer Name
- Aluminium tri-sec-butoxide
- Summenformel
- C4H13AlO
- Molmasse
- 104.13
Namen und Synonyme
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Datenbank-Bezeichner
- CAS
2269-22-9- PubChem CID
- 61289
- DTXSID
DTXSID3044386- UNII
- FE7IK35OPN
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 69,2 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 19,6
Physikochemische Eigenschaften
- Siedepunkt
- 40 °C · 40 °C
- Dichte
- 0.967 g/mL · 0.967 g/mL at 25 °C(lit.)
- Dampfdruck
- 23 hPa · 23 hPa (195 °C)
- Brechungsindex
- 1.439 · 1.4390
- Flammpunkt
- 82 °F · 82 °F
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- Miscible with alcohol, isopropyl alcohol and toluene.
- Aggregatzustand
- Oily Liquid
- Farbe
- Light yellow
- Wichte
- 0.9671 · 0.9671
- Explosionsgrenze
- 1.7 · 1.7-9.8%(V)
- Wasserlöslichkeit
- decomposes
- BRN
- 3910908 · 3910908
- Stabilität
- Stability Stable, but may decompose upon exposure to air and moisture. Flammable. Incompatible with strong oxidizing agents, strong acids, water.
- Kosmetik-Inhaltsstoffe Funktionen
- LIGHT STABILIZER
- InChI
- 1S/3C4H9O.Al/c3*1-3-4(2)5;/h3*4H,3H2,1-2H3;/q3*-1;+3
- InChIKey
- WOZZOSDBXABUFO-UHFFFAOYSA-N
- SMILES
- CCC(C)O[Al](OC(C)CC)OC(C)CC
- CAS Datenbank
- 2269 · 2269-22-9(CAS DataBase Reference)
- NIST chemische Informationen
- Aluminum tri-sec-butoxide(2269-22-9)
- EPA chemische Informationen
- 2 · 2-Butanol, aluminum salt (2269-22-9)
Sicherheit und Regulatorisches
Sicherheit und Schutzausrüstung
Toxikologische Informationen
Health Effects
Aluminum targets the nervous system and causes decreased nervous system performance and is associated with altered function of the blood-brain barrier. The accumulation of aluminum in the body may cause bone or brain diseases. High levels of aluminum have been linked to Alzheimer's disease. A small percentage of people are allergic to aluminium and experience contact dermatitis, digestive disorders, vomiting or other symptoms upon contact or ingestion of products containing aluminium. (L739, L740)
Toxicity Summary
The main target organs of aluminum are the central nervous system and bone. Aluminum binds with dietary phosphorus and impairs gastrointestinal absorption of phosphorus. The decreased phosphate body burden results in osteomalacia (softening of the bones due to defective bone mineralization) and rickets. Aluminum's neurotoxicity is believed to involve several mechanisms. Changes in cytoskeletal protein functions as a results of altered phosphorylation, proteolysis, transport, and synthesis are believed to be one cause. Aluminum may induce neurobehavioral effects by affecting permeability of the blood-brain barrier, cholinergic activity, signal transduction pathways, lipid peroxidation, and impair neuronal glutamate nitric oxide-cyclic GMP pathway, as well as interfere with metabolism of essential trace elements because of similar coordination chemistries and consequent competitive interactions. It has been suggested that aluminum's interaction with estrogen receptors increases the expression of estrogen-related genes and thereby contributes to the progression of breast cancer (A235), but studies have not been able to establish a clear link between aluminum and increased risk of breast cancer (A15468). Certain aluminum salts induce immune responses by activating inflammasomes. (L739, A235, A236)
Signs and Symptoms
Inhalating aluminum dust causes coughing and abnormal chest X-rays. A small percentage of people are allergic to aluminium and experience contact dermatitis, digestive disorders, vomiting or other symptoms upon contact or ingestion of products containing aluminium. (L739, L740)
Carcinogen Classification
Not listed by IARC. IARC classified aluminum production as carcinogenic to humans (Group 1), but did not implicate aluminum itself as a human carcinogen. (L135) A link between use of aluminum-containing antiperspirants and increased risk of breast cancer has been proposed (A235), but studies have not been able to establish a clear link (A15468).
Sicherheitsdaten
- F
- 3-10-23
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1992 3/PG 3
- hs_code
- 29051900
- risk_code
- 40-21/22-10
- Toxizität
- LD50 orally in Rabbit: 401 mg/kg LD50 dermal Rabbit 402 mg/kg
- hazard_code
- Xn,Xi
- safety_code
- 36/37-45-43-36/37/39-26-16
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 4 OralFlam. Liq. 3
- Selbstentzündungstemperatur
- 763 °F
Chemie und Industrie
Pharmakologische Informationen
Metabolism/Metabolites
Aluminum is poorly absorbed following either oral or inhalation exposure and is essentially not absorbed dermally. The bioavailability of aluminum is strongly influenced by the aluminum compound and the presence of dietary constituents which can complex with aluminum and enhance or inhibit its absorption. Aluminum binds to various ligands in the blood and distributes to every organ, with highest concentrations found in bone and lung tissues. In living organisms, aluminum is believed to exist in four different forms: as free ions, as low-molecular-weight complexes, as physically bound macromolecular complexes, and as covalently bound macromolecular complexes. Absorbed aluminum is excreted principally in the urine and, to a lesser extent, in the bile, while unabsorbed aluminum is excreted in the faeces. (L739)
Anwendungen
VerwendenIt is used for active catalyst and support, inorganic membrane, redrcing agent of aldehyde-ketone, oxidant of aldehyde-ketone, gel forming agent of printing ink and paint, dehydrant, water proofing agent and aluminum base grease.
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