8-甲基-1-壬醇1,1'-(氢磷酸酯)
TL;DR: 8-甲基-1-壬醇1,1'-(氢磷酸酯) (CAS 67953-31-5) is a chemical compound with molecular formula C20H43O4P and molecular weight 378.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-甲基-1-壬醇1,1'-(氢磷酸酯)
bis(8-methylnonyl) hydrogen phosphate
Also Known As: BIS PHOSPHATE, diisodecylphosphoric acid, Phosphoric acid, diisodecyl ester, 1-Nonanol, 8-methyl-, hydrogen phosphate, bis(8-methylnonyl) hydrogen phosphate
| Molecular Formula | C20H43O4P |
|---|---|
| Molecular Weight | 378.29 g/mol |
| LogP | 7.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 378.2899 |
| Heavy Atoms | 25 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 67953-31-5 |
|---|---|
| SMILES | CC(C)CCCCCCCOP(=O)(O)OCCCCCCCC(C)C |
| InChIKey | IAONKHJEAQWGBJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-甲基-1-壬醇1,1'-(氢磷酸酯) (CAS 67953-31-5), with molecular formula C20H43O4P and molecular weight 378.29 g/mol. IUPAC: bis(8-methylnonyl) hydrogen phosphate.
Chemical Property Profile of 8-甲基-1-壬醇1,1'-(氢磷酸酯)
Property Insights of 8-甲基-1-壬醇1,1'-(氢磷酸酯)
The XLogP value of 7.4 indicates that 8-甲基-1-壬醇1,1'-(氢磷酸酯) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 8-甲基-1-壬醇1,1'-(氢磷酸酯) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-甲基-1-壬醇1,1'-(氢磷酸酯) has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-甲基-1-壬醇1,1'-(氢磷酸酯)?
The CAS number of 8-甲基-1-壬醇1,1'-(氢磷酸酯) is 67953-31-5.
What is the molecular formula of 8-甲基-1-壬醇1,1'-(氢磷酸酯)?
The molecular formula of 8-甲基-1-壬醇1,1'-(氢磷酸酯) is C20H43O4P.
What is the molecular weight of 8-甲基-1-壬醇1,1'-(氢磷酸酯)?
The molecular weight of 8-甲基-1-壬醇1,1'-(氢磷酸酯) is 378.29 g/mol.
Where can I buy 8-甲基-1-壬醇1,1'-(氢磷酸酯)?
You can request a quote for 8-甲基-1-壬醇1,1'-(氢磷酸酯) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-甲基-1-壬醇1,1'-(氢磷酸酯)?
Yes, KEHONG BIO provides custom synthesis services for 8-甲基-1-壬醇1,1'-(氢磷酸酯) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.