Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate
TL;DR: Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate (CAS 17677-92-8) is a chemical compound with molecular formula C8H12Cl7O3P and molecular weight 431.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trichloro-2-[chloro-(1,1,1-trichloro-2-methylpropan-2-yl)oxyphosphoryl]oxy-2-methylpropane
Also Known As: Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate, 1,1,1-trichloro-2-[chloro-(1,1,1-trichloro-2-methylpropan-2-yl)oxyphosphoryl]oxy-2-methylpropane
| Molecular Formula | C8H12Cl7O3P |
|---|---|
| Molecular Weight | 431.83 g/mol |
| LogP | 6.6641 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.83438 |
| Heavy Atoms | 19 |
| Complexity | 339.5193 |
Chemical Identifiers
| CAS Number | 17677-92-8 |
|---|---|
| SMILES | CC(C)(C(Cl)(Cl)Cl)OP(=O)(OC(C)(C)C(Cl)(Cl)Cl)Cl |
Product Overview
Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate (CAS 17677-92-8), with molecular formula C8H12Cl7O3P and molecular weight 431.83 g/mol. IUPAC: 1,1,1-trichloro-2-[chloro-(1,1,1-trichloro-2-methylpropan-2-yl)oxyphosphoryl]oxy-2-methylpropane.
Chemical Property Profile of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate
Property Insights of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate
The XLogP value of 6.6641 indicates that Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate?
The CAS number of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate is 17677-92-8.
What is the molecular formula of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate?
The molecular formula of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate is C8H12Cl7O3P.
What is the molecular weight of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate?
The molecular weight of Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate is 431.83 g/mol.
Where can I buy Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate?
You can request a quote for Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2,2,2-trichloro-1,1-dimethylethyl) phosphorochloridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.