4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide
TL;DR: 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide (CAS 40535-35-1) is a chemical compound with molecular formula C9H13N2O3P and molecular weight 228.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-phenoxy-1,3,4,2λ5-oxadiazaphosphinane 2-oxide
Also Known As: 4-methyl-2-phenoxy-1,3,4,2, 4-methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide, 4-Methyl-2-phenoxy-1,3,4,2-oxadiazaphosphinane 2-oxide, 4-Methyl-2-phenoxy-1,3,4,2lambda~5~-oxadiazaphosphinan-2-one, 4-methyl-2-phenoxy-1,3,4,2$l^{5}-oxadiazaphosphinane 2-oxide
| Molecular Formula | C9H13N2O3P |
|---|---|
| Molecular Weight | 228.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.06638 |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 40535-35-1 |
|---|---|
| SMILES | CN1CCOP(=O)(N1)OC2=CC=CC=C2 |
| InChIKey | HBPZBIWFGCQLPT-UHFFFAOYSA-N |
Product Overview
4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide (CAS 40535-35-1), with molecular formula C9H13N2O3P and molecular weight 228.07 g/mol. IUPAC: 4-methyl-2-phenoxy-1,3,4,2λ5-oxadiazaphosphinane 2-oxide.
Chemical Property Profile of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide
Property Insights of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide. With a topological polar surface area (TPSA) of 50.8 Ų, 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide has 1 hydrogen bond donor(s) and 5 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 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide?
The CAS number of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide is 40535-35-1.
What is the molecular formula of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide?
The molecular formula of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide is C9H13N2O3P.
What is the molecular weight of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide?
The molecular weight of 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide is 228.07 g/mol.
Where can I buy 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide?
You can request a quote for 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2-phenoxy-1,3,4,2lambda5-oxadiazaphosphinane 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.