RefChem:111624
TL;DR: RefChem:111624 (CAS 68309-99-9) is a chemical compound with molecular formula C17H39AlO4 and molecular weight 334.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aluminum;2-ethylhexan-1-olate;hydron;tris(propan-2-olate)
Also Known As: Hydrogen (2-ethylhexan-1-olato)tris(propan-2-olato)aluminate, aluminum; 2-ethylhexan-1-olate; hydron; propan-2-olate, Hydrogen(2-ethylhexan-1-olato)tris(propan-2-olato)aluminate, Aluminate(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)-
| Molecular Formula | C17H39AlO4 |
|---|---|
| Molecular Weight | 334.27 g/mol |
| LogP | 0.56 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.2664 |
| Heavy Atoms | 22 |
| Complexity | 63.0 |
Chemical Identifiers
| CAS Number | 68309-99-9 |
|---|---|
| SMILES | [H+].CCCCC(CC)C[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3] |
| InChIKey | STQWFFBMELDDQL-UHFFFAOYSA-O |
Product Overview
RefChem:111624 (CAS 68309-99-9), with molecular formula C17H39AlO4 and molecular weight 334.27 g/mol. IUPAC: aluminum;2-ethylhexan-1-olate;hydron;tris(propan-2-olate).
Chemical Property Profile of RefChem:111624
Property Insights of RefChem:111624
The XLogP value of 0.56 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:111624. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:111624. Following Lipinski's Rule of Five, RefChem:111624 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:111624?
The CAS number of RefChem:111624 is 68309-99-9.
What is the molecular formula of RefChem:111624?
The molecular formula of RefChem:111624 is C17H39AlO4.
What is the molecular weight of RefChem:111624?
The molecular weight of RefChem:111624 is 334.27 g/mol.
Where can I buy RefChem:111624?
You can request a quote for RefChem:111624 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:111624?
Yes, KEHONG BIO provides custom synthesis services for RefChem:111624 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.