磷酸癸基辛酯
TL;DR: 磷酸癸基辛酯 (CAS 68186-45-8) is a chemical compound with molecular formula C16H35O4P and molecular weight 322.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磷酸癸基辛酯
heptyl nonyl hydrogen phosphate
Also Known As: heptyl nonyl hydrogen phosphate, Phosphoric acid, decyl octyl ester, HEPTOXY-NONOXY-PHOSPHINIC ACID, Phosphoric acid, n-octyl, n-decyl esters, 269-041-1
| Molecular Formula | C16H35O4P |
|---|---|
| Molecular Weight | 322.23 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 322.2273 |
| Heavy Atoms | 21 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 68186-45-8 |
|---|---|
| SMILES | CCCCCCCCCOP(=O)(O)OCCCCCCC |
| InChIKey | NYKANSKCKXDDMQ-UHFFFAOYSA-N |
Product Overview
磷酸癸基辛酯 (CAS 68186-45-8), with molecular formula C16H35O4P and molecular weight 322.23 g/mol. IUPAC: heptyl nonyl hydrogen phosphate.
Chemical Property Profile of 磷酸癸基辛酯
Property Insights of 磷酸癸基辛酯
The XLogP value of 5.8 indicates that 磷酸癸基辛酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 磷酸癸基辛酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 磷酸癸基辛酯 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 磷酸癸基辛酯?
The CAS number of 磷酸癸基辛酯 is 68186-45-8.
What is the molecular formula of 磷酸癸基辛酯?
The molecular formula of 磷酸癸基辛酯 is C16H35O4P.
What is the molecular weight of 磷酸癸基辛酯?
The molecular weight of 磷酸癸基辛酯 is 322.23 g/mol.
Where can I buy 磷酸癸基辛酯?
You can request a quote for 磷酸癸基辛酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磷酸癸基辛酯?
Yes, KEHONG BIO provides custom synthesis services for 磷酸癸基辛酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.