Monotridecyl phosphate
TL;DR: Monotridecyl phosphate (CAS 5116-94-9) is a chemical compound with molecular formula C13H29O4P and molecular weight 280.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tridecyl dihydrogen phosphate
Also Known As: Monotridecyl phosphate, tridecyl dihydrogen phosphate, Tridecyl acid phosphate, Tridecyl phosphate, C12-15-Alkyl phosphates
| Molecular Formula | C13H29O4P |
|---|---|
| Molecular Weight | 280.18 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 280.18036 |
| Heavy Atoms | 18 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 5116-94-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCOP(=O)(O)O |
| InChIKey | GAJQCIFYLSXSEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Monotridecyl phosphate (CAS 5116-94-9), with molecular formula C13H29O4P and molecular weight 280.18 g/mol. IUPAC: tridecyl dihydrogen phosphate.
Chemical Property Profile of Monotridecyl phosphate
Property Insights of Monotridecyl phosphate
The XLogP value of 4.6 indicates that Monotridecyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Monotridecyl phosphate. Following Lipinski's Rule of Five, Monotridecyl phosphate has 2 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 Monotridecyl phosphate?
The CAS number of Monotridecyl phosphate is 5116-94-9.
What is the molecular formula of Monotridecyl phosphate?
The molecular formula of Monotridecyl phosphate is C13H29O4P.
What is the molecular weight of Monotridecyl phosphate?
The molecular weight of Monotridecyl phosphate is 280.18 g/mol.
Where can I buy Monotridecyl phosphate?
You can request a quote for Monotridecyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Monotridecyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Monotridecyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.