1-Propanol, 2-methyl-, aluminum salt (3:1)
TL;DR: 1-Propanol, 2-methyl-, aluminum salt (3:1) (CAS 81690-06-4) 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.
aluminum tris(2-methylpropan-1-olate)
Also Known As: Aluminium 2-methylpropanolate, aluminium sec-butoxide, aluminium secondary butoxide, Aluminum 2-methylpropanolate, 1-Propanol, 2-methyl-, aluminum salt
| Molecular Formula | C12H27AlO3 |
|---|---|
| Molecular Weight | 246.18 g/mol |
| LogP | -0.3727 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.17755 |
| Heavy Atoms | 16 |
| Complexity | 17.0 |
Chemical Identifiers
| CAS Number | 81690-06-4 |
|---|---|
| SMILES | CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].[Al+3] |
| InChIKey | DAOVYDBYKGXFOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanol, 2-methyl-, aluminum salt (3:1) (CAS 81690-06-4), with molecular formula C12H27AlO3 and molecular weight 246.18 g/mol. IUPAC: aluminum tris(2-methylpropan-1-olate).
Chemical Property Profile of 1-Propanol, 2-methyl-, aluminum salt (3:1)
Property Insights of 1-Propanol, 2-methyl-, aluminum salt (3:1)
The XLogP value of -0.3727 indicates that 1-Propanol, 2-methyl-, aluminum salt (3:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanol, 2-methyl-, aluminum salt (3:1). Following Lipinski's Rule of Five, 1-Propanol, 2-methyl-, aluminum salt (3:1) 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 1-Propanol, 2-methyl-, aluminum salt (3:1)?
The CAS number of 1-Propanol, 2-methyl-, aluminum salt (3:1) is 81690-06-4.
What is the molecular formula of 1-Propanol, 2-methyl-, aluminum salt (3:1)?
The molecular formula of 1-Propanol, 2-methyl-, aluminum salt (3:1) is C12H27AlO3.
What is the molecular weight of 1-Propanol, 2-methyl-, aluminum salt (3:1)?
The molecular weight of 1-Propanol, 2-methyl-, aluminum salt (3:1) is 246.18 g/mol.
Where can I buy 1-Propanol, 2-methyl-, aluminum salt (3:1)?
You can request a quote for 1-Propanol, 2-methyl-, aluminum salt (3:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanol, 2-methyl-, aluminum salt (3:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanol, 2-methyl-, aluminum salt (3:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.