高氯酸叔丁酯
TL;DR: 高氯酸叔丁酯 (CAS 6380-69-4) is a chemical compound with molecular formula C4H9ClO4 and molecular weight 156.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
高氯酸叔丁酯
tert-butyl perchlorate
Also Known As: tert-Butyl perchlorate, tert-butylperchlorate, Hyperchloric acid tert-butyl ester, Perchloric acid,1,1-dimethylethyl ester, PERCHLORIC ACID, TERT-BUTYL ESTER
| Molecular Formula | C4H9ClO4 |
|---|---|
| Molecular Weight | 156.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.01894 |
| Heavy Atoms | 9 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 6380-69-4 |
|---|---|
| SMILES | CC(C)(C)OCl(=O)(=O)=O |
| InChIKey | AFSIIZRPQXBCFM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
高氯酸叔丁酯 (CAS 6380-69-4), with molecular formula C4H9ClO4 and molecular weight 156.02 g/mol. IUPAC: tert-butyl perchlorate.
Chemical Property Profile of 高氯酸叔丁酯
Property Insights of 高氯酸叔丁酯
The XLogP value of 3.8 indicates that 高氯酸叔丁酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 高氯酸叔丁酯. Following Lipinski's Rule of Five, 高氯酸叔丁酯 has 0 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 高氯酸叔丁酯?
The CAS number of 高氯酸叔丁酯 is 6380-69-4.
What is the molecular formula of 高氯酸叔丁酯?
The molecular formula of 高氯酸叔丁酯 is C4H9ClO4.
What is the molecular weight of 高氯酸叔丁酯?
The molecular weight of 高氯酸叔丁酯 is 156.02 g/mol.
Where can I buy 高氯酸叔丁酯?
You can request a quote for 高氯酸叔丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 高氯酸叔丁酯?
Yes, KEHONG BIO provides custom synthesis services for 高氯酸叔丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.