Diethylaluminum ethoxide - ≥97% , CAS No.1586-92-1

CAS: 1586-92-1 Cat. No.: D468797 Molecular Weight: 130.16 EC Number: 216-447-1

GRADE & PURITY ≥97%

Synonyms

Diethylaluminum ethoxide, 97% | DTXSID7061803 | UNII-XW23K7N9ZK | diethylalumanylium;ethanolate | ethoxy(diethyl)alumane | Aluminum, ethoxydiethyl- | AKOS015915768 | DIETHYLALUMINUMETHOXIDE | EINECS 216-447-1 | FT-0633685 | DEALOX | diethyl aluminum ethox

Storage

Room temperature

Specifications

Synonyms

Diethylaluminum ethoxide, 97% | DTXSID7061803 | UNII-XW23K7N9ZK | diethylalumanylium;ethanolate | ethoxy(diethyl)alumane | Aluminum, ethoxydiethyl- | AKOS015915768 | DIETHYLALUMINUMETHOXIDE | EINECS 216-447-1 | FT-0633685 | DEALOX | diethyl aluminum ethox

Specifications & Purity

≥97%

Storage

Room temperature

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCO[Al](CC)CC
• IUPAC Name: ethoxy(diethyl)alumane
• InChIKey: GCPCLEKQVMKXJM-UHFFFAOYSA-N
• INCHI: 1S/C2H5O.2C2H5.Al/c1-2-3;2*1-2;/h2H2,1H3;2*1H2,2H3;/q-1;;;+1
• Isomeric SMILES: CCO[Al](CC)CC
• UN Number: 3394
• Molecular Weight: 130.16
• Reaxy-Rn: 3660234
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3660234&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Class Organic metal salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Class: Organic metal salts
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic metal salts
• Alternative Parents: Organooxygen compounds Hydrocarbon derivatives Alkylaluminium and derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic metal salt - Organic oxygen compound - Alkylaluminium or derivatives - Hydrocarbon derivative - Organooxygen compound - Organometallic compound - Organoaluminium-compound - Organic post-transition metal moeity - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic metal salts. These are organic salt compounds containing a metal atom in its ionic form.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Flash Point(°F): Not applicable
• Flash Point(°C): Not applicable
• Boil Point(°C): 108-109℃/10mmHg (lit.)
• Melt Point(°C): 2.5-4.5℃ (lit.)
• Molecular Weight: 130.160 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 130.094 Da
• Monoisotopic Mass: 130.094 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 43.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

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