3,5-Xylyl phosphorodichloridate
TL;DR: 3,5-Xylyl phosphorodichloridate (CAS 775-08-6) is a chemical compound with molecular formula C8H9Cl2O2P and molecular weight 237.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dichlorophosphoryloxy-3,5-dimethylbenzene
Also Known As: 3,5-Xylyl phosphorodichloridate, 1-dichlorophosphoryloxy-3,5-dimethylbenzene, 3,5-Dimethylphenyl phosphorodichloridate, Dichlorophosphinic acid 3,5-xylyl ester, 3,5-dimethylphenyl chlorophosphonochloridate
| Molecular Formula | C8H9Cl2O2P |
|---|---|
| Molecular Weight | 237.97 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.97173 |
| Heavy Atoms | 13 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 775-08-6 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OP(=O)(Cl)Cl)C |
| InChIKey | FZYHTHFEIUVTNL-UHFFFAOYSA-N |
Product Overview
3,5-Xylyl phosphorodichloridate (CAS 775-08-6), with molecular formula C8H9Cl2O2P and molecular weight 237.97 g/mol. IUPAC: 1-dichlorophosphoryloxy-3,5-dimethylbenzene.
Chemical Property Profile of 3,5-Xylyl phosphorodichloridate
Property Insights of 3,5-Xylyl phosphorodichloridate
The XLogP value of 3.5 indicates that 3,5-Xylyl phosphorodichloridate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3,5-Xylyl phosphorodichloridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Xylyl phosphorodichloridate has 0 hydrogen bond donor(s) and 2 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 3,5-Xylyl phosphorodichloridate?
The CAS number of 3,5-Xylyl phosphorodichloridate is 775-08-6.
What is the molecular formula of 3,5-Xylyl phosphorodichloridate?
The molecular formula of 3,5-Xylyl phosphorodichloridate is C8H9Cl2O2P.
What is the molecular weight of 3,5-Xylyl phosphorodichloridate?
The molecular weight of 3,5-Xylyl phosphorodichloridate is 237.97 g/mol.
Where can I buy 3,5-Xylyl phosphorodichloridate?
You can request a quote for 3,5-Xylyl phosphorodichloridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Xylyl phosphorodichloridate?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Xylyl phosphorodichloridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.