Aluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen (1:1), (T-4)-
Basic information
- CAS
68309-99-9- Standard SMILES
CC(C)[O-].CC(C)[O-].CC(C)[O-].CCCCC(CC)C[O-].[Al+3].[H+]- InChIKey
STQWFFBMELDDQL-UHFFFAOYSA-O- Molecular formula
- C17H38AlO4.H
- Average molar mass
- 334.5 g/mol
- Monoisotopic mass
- 334.2663731
Names & identifiers
- Preferred name
- Aluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen (1:1), (T-4)-
- IUPAC
- aluminum;2-ethylhexan-1-olate;hydron;tris(propan-2-olate)
Names & synonyms
68309-99-9EINECS 269-686-9Aluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen (1:1), (T-4)-Aluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen, (beta-4)-RefChem:111624Hydrogen (2-ethylhexan-1-olato)tris(propan-2-olato)aluminateSTQWFFBMELDDQL-UHFFFAOYSA-O
Database identifiers
- CAS
68309-99-9- PubChem CID
- 109286
- EC Number
- 269-686-9
Properties
Computed structural properties
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 63.3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 75% (3 of 4) of all reports.
Danger
H225 (25%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Aluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen, (T-4)-
Aluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen, (T-4)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesFlam. Liq. 2 (25%)
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAluminate(1-), (2-ethyl-1-hexanolato)tris(2-propanolato)-, hydrogen (1:1), (T-4)-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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