Tetrakis(2-ethylhexan-1-olate);zirconium(4+)
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Basic information
- CAS
118775-98-7- Standard SMILES
CCCCC(CC)C[O][Zr]([O]CC(CC)CCCC)([O]CC(CC)CCCC)[O]CC(CC)CCCC- InChIKey
ZIMOQLAACWTTMO-UHFFFAOYSA-N- Molecular formula
- C32H68O4Zr
- Average molar mass
- 608.1 g/mol
Names & identifiers
- Preferred name
- Tetrakis(2-ethylhexan-1-olate);zirconium(4+)
- IUPAC
- tetrakis(2-ethylhexan-1-olate);zirconium(4+)
- English name
- Zirconium 2-ethylhexoxide
- Molecular formula
- C32H68O4Zr
- Molecular weight
- 608.1
Names & synonyms
SCHEMBL333422TETRAOCTYLZIRCONATEZirconium 2-ethylhexoxideZIRCONIUM 2-ETHYLHEXOXIDE, 70% in 2-ethylhexanol
Database identifiers
- CAS
118775-98-7
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 20
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 52.5
Physicochemical properties
- Melting point
- 55 · 55-60°C
- Density
- 1 g/cm3 · 1 g/cm3
- Flash point
- 65 °C · >65°C
- Specific Gravity
- 0.946 · 0.946
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- TSCA
- No
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- No
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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