十二烷基丁二过氧酸
TL;DR: 十二烷基丁二过氧酸 (CAS 87458-70-6) is a chemical compound with molecular formula C16H30O6 and molecular weight 318.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
十二烷基丁二过氧酸
2-dodecylbutanediperoxoic acid
Also Known As: Butanediperoxoic acid, dodecyl-, 2-dodecylbutanediperoxoic acid
| Molecular Formula | C16H30O6 |
|---|---|
| Molecular Weight | 318.20 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 318.20422 |
| Heavy Atoms | 22 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 87458-70-6 |
|---|---|
| SMILES | CCCCCCCCCCCCC(CC(=O)OO)C(=O)OO |
| InChIKey | VQNGHUKPEOOZEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
十二烷基丁二过氧酸 (CAS 87458-70-6), with molecular formula C16H30O6 and molecular weight 318.20 g/mol. IUPAC: 2-dodecylbutanediperoxoic acid.
Chemical Property Profile of 十二烷基丁二过氧酸
Property Insights of 十二烷基丁二过氧酸
The XLogP value of 5.2 indicates that 十二烷基丁二过氧酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 十二烷基丁二过氧酸. Following Lipinski's Rule of Five, 十二烷基丁二过氧酸 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 十二烷基丁二过氧酸?
The CAS number of 十二烷基丁二过氧酸 is 87458-70-6.
What is the molecular formula of 十二烷基丁二过氧酸?
The molecular formula of 十二烷基丁二过氧酸 is C16H30O6.
What is the molecular weight of 十二烷基丁二过氧酸?
The molecular weight of 十二烷基丁二过氧酸 is 318.20 g/mol.
Where can I buy 十二烷基丁二过氧酸?
You can request a quote for 十二烷基丁二过氧酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 十二烷基丁二过氧酸?
Yes, KEHONG BIO provides custom synthesis services for 十二烷基丁二过氧酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.