辛酸与1-丁胺复合物 (1:1)
TL;DR: 辛酸与1-丁胺复合物 (1:1) (CAS 67244-24-0) is a chemical compound with molecular formula C12H27NO2 and molecular weight 217.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
辛酸与1-丁胺复合物 (1:1)
butan-1-amine;octanoic acid
Also Known As: butylammonium octanoate, butan-1-amine,octanoic acid, butan-1-amine;octanoic acid, Octanoic acid, compd. with 1-butanamine (1:1), butan-1-amine; octanoic acid
| Molecular Formula | C12H27NO2 |
|---|---|
| Molecular Weight | 217.20 g/mol |
| LogP | 3.1767 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 217.20418 |
| Heavy Atoms | 15 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 67244-24-0 |
|---|---|
| SMILES | CCCCCCCC(=O)O.CCCCN |
| InChIKey | SGTADWDVCKFNIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
辛酸与1-丁胺复合物 (1:1) (CAS 67244-24-0), with molecular formula C12H27NO2 and molecular weight 217.20 g/mol. IUPAC: butan-1-amine;octanoic acid.
Chemical Property Profile of 辛酸与1-丁胺复合物 (1:1)
Property Insights of 辛酸与1-丁胺复合物 (1:1)
The XLogP value of 3.1767 indicates that 辛酸与1-丁胺复合物 (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 辛酸与1-丁胺复合物 (1:1). Following Lipinski's Rule of Five, 辛酸与1-丁胺复合物 (1:1) has 2 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 辛酸与1-丁胺复合物 (1:1)?
The CAS number of 辛酸与1-丁胺复合物 (1:1) is 67244-24-0.
What is the molecular formula of 辛酸与1-丁胺复合物 (1:1)?
The molecular formula of 辛酸与1-丁胺复合物 (1:1) is C12H27NO2.
What is the molecular weight of 辛酸与1-丁胺复合物 (1:1)?
The molecular weight of 辛酸与1-丁胺复合物 (1:1) is 217.20 g/mol.
Where can I buy 辛酸与1-丁胺复合物 (1:1)?
You can request a quote for 辛酸与1-丁胺复合物 (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 辛酸与1-丁胺复合物 (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 辛酸与1-丁胺复合物 (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.