叔丁醇铝
TL;DR: 叔丁醇铝 (CAS 556-91-2) is a chemical compound with molecular formula C12H27AlO3 and molecular weight 246.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
叔丁醇铝
aluminum tris(2-methylpropan-2-olate)
Also Known As: Aluminum tert-butoxide, Aluminum tert-butylate, aluminum t-butoxide, Aluminum tert-butanolate, Aluminum tri-tert-butoxide
| Molecular Formula | C12H27AlO3 |
|---|---|
| Molecular Weight | 246.18 g/mol |
| LogP | 0.05 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.17755 |
| Heavy Atoms | 16 |
| Complexity | 25.0 |
Chemical Identifiers
| CAS Number | 556-91-2 |
|---|---|
| SMILES | CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].[Al+3] |
| InChIKey | MDDPTCUZZASZIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
叔丁醇铝 (CAS 556-91-2), with molecular formula C12H27AlO3 and molecular weight 246.18 g/mol. IUPAC: aluminum tris(2-methylpropan-2-olate).
Chemical Property Profile of 叔丁醇铝
Property Insights of 叔丁醇铝
The XLogP value of 0.05 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 叔丁醇铝. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 叔丁醇铝. Following Lipinski's Rule of Five, 叔丁醇铝 has 0 hydrogen bond donor(s) and 3 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 叔丁醇铝?
The CAS number of 叔丁醇铝 is 556-91-2.
What is the molecular formula of 叔丁醇铝?
The molecular formula of 叔丁醇铝 is C12H27AlO3.
What is the molecular weight of 叔丁醇铝?
The molecular weight of 叔丁醇铝 is 246.18 g/mol.
Where can I buy 叔丁醇铝?
You can request a quote for 叔丁醇铝 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 叔丁醇铝?
Yes, KEHONG BIO provides custom synthesis services for 叔丁醇铝 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.