Isopropylbicyclophosphate
TL;DR: Isopropylbicyclophosphate (CAS 51052-72-3) is a chemical compound with molecular formula C7H13O4P and molecular weight 192.05515 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-propan-2-yl-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
Also Known As: 4-Isopropylbicyclophosphate, Isobicyphat, IPTBO, Isopropylbicyclophosphate, Isopropyl bicyclic phosphate
Technical Specifications
| Molecular Formula | C7H13O4P |
| Molecular Weight | 192.05515 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.05515 Da |
| Heavy Atoms | 12 |
| Complexity | 206.0 |
| SMILES | CC(C)C12COP(=O)(OC1)OC2 |
| InChIKey | CIEZMYRJRCLYNF-UHFFFAOYSA-N |
Chemical Property Profile of Isopropylbicyclophosphate
Property Insights of Isopropylbicyclophosphate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylbicyclophosphate. With a topological polar surface area (TPSA) of 44.8 Ų, Isopropylbicyclophosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropylbicyclophosphate 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
What is the CAS number of Isopropylbicyclophosphate?
The CAS number of Isopropylbicyclophosphate is 51052-72-3.
What is the molecular formula of Isopropylbicyclophosphate?
The molecular formula of Isopropylbicyclophosphate is C7H13O4P.
What is the molecular weight of Isopropylbicyclophosphate?
The molecular weight of Isopropylbicyclophosphate is 192.05515 g/mol.
Where can I buy Isopropylbicyclophosphate?
You can request a quote for Isopropylbicyclophosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isopropylbicyclophosphate?
Yes, CoreyChem provides custom synthesis services for Isopropylbicyclophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.