Triisopropyl phosphate
TL;DR: Triisopropyl phosphate (CAS 513-02-0) is a chemical compound with molecular formula C9H21O4P and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tripropan-2-yl phosphate
Also Known As: Triisopropyl phosphate, Triisopropylphosphate, tripropan-2-yl phosphate, Triisoproyl phosphate, ISOPROPYL PHOSPHATE
| Molecular Formula | C9H21O4P |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.11775 |
| Heavy Atoms | 14 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 513-02-0 |
|---|---|
| SMILES | CC(C)OP(=O)(OC(C)C)OC(C)C |
| InChIKey | OXFUXNFMHFCELM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triisopropyl phosphate (CAS 513-02-0), with molecular formula C9H21O4P and molecular weight 224.12 g/mol. IUPAC: tripropan-2-yl phosphate.
Chemical Property Profile of Triisopropyl phosphate
Property Insights of Triisopropyl phosphate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triisopropyl phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, Triisopropyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triisopropyl phosphate 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 Triisopropyl phosphate?
The CAS number of Triisopropyl phosphate is 513-02-0.
What is the molecular formula of Triisopropyl phosphate?
The molecular formula of Triisopropyl phosphate is C9H21O4P.
What is the molecular weight of Triisopropyl phosphate?
The molecular weight of Triisopropyl phosphate is 224.12 g/mol.
Where can I buy Triisopropyl phosphate?
You can request a quote for Triisopropyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triisopropyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for Triisopropyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.