![2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide structure](/static/products/849/84957-80-2.png)
2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide
TL;DR: 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide (CAS 84957-80-2) is a chemical compound with molecular formula C13H19N2O2P and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide
Also Known As: 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide, 2-(3-Methylphenoxy)octahydro-1H-1,3,2-benzodiazaphosphole 2-oxide, 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,, 2-(4-Methylphenoxy)octahydro-1H-1,3,2-benzodiazaphosphole 2-oxide #, 2-(4-Methylphenoxy)octahydro-1H-1,3,2lambda~5~-benzodiazaphosphol-2-one
| Molecular Formula | C13H19N2O2P |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.1184 |
| Heavy Atoms | 18 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 84957-80-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OP2(=O)NC3CCCCC3N2 |
| InChIKey | JJCPPZKNTVGGRE-UHFFFAOYSA-N |
Product Overview
2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide (CAS 84957-80-2), with molecular formula C13H19N2O2P and molecular weight 266.12 g/mol. IUPAC: 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide.
Chemical Property Profile of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide
Property Insights of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide. With a topological polar surface area (TPSA) of 50.4 Ų, 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide 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 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide?
The CAS number of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide is 84957-80-2.
What is the molecular formula of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide?
The molecular formula of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide is C13H19N2O2P.
What is the molecular weight of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide?
The molecular weight of 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide is 266.12 g/mol.
Where can I buy 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide?
You can request a quote for 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-methylphenoxy)-1,3,3a,4,5,6,7,7a-octahydrobenzo[d][1,3,2]diazaphosphole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.