5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one
TL;DR: 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one (CAS 78146-72-2) is a chemical compound with molecular formula C13H19O4P and molecular weight 270.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-2-phenoxy-1,3,2λ5-dioxaphosphinane 2-oxide
Also Known As: 5-tert-butyl-2-phenoxy-1,3,2, 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one, 5-tert-butyl-2-phenoxy-1,3,2lambda5-dioxaphosphinane 2-oxide
| Molecular Formula | C13H19O4P |
|---|---|
| Molecular Weight | 270.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.10208 |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 78146-72-2 |
|---|---|
| SMILES | CC(C)(C)C1COP(=O)(OC1)OC2=CC=CC=C2 |
| InChIKey | DIAJXXIPXPCGMB-UHFFFAOYSA-N |
Product Overview
5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one (CAS 78146-72-2), with molecular formula C13H19O4P and molecular weight 270.10 g/mol. IUPAC: 5-tert-butyl-2-phenoxy-1,3,2λ5-dioxaphosphinane 2-oxide.
Chemical Property Profile of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one
Property Insights of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one
The XLogP value of 3.1 indicates that 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one 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 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one?
The CAS number of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one is 78146-72-2.
What is the molecular formula of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one?
The molecular formula of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one is C13H19O4P.
What is the molecular weight of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one?
The molecular weight of 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one is 270.10 g/mol.
Where can I buy 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one?
You can request a quote for 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-tert-Butyl-2-phenoxy-1,3,2lambda~5~-dioxaphosphinan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.