Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)
TL;DR: Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) (CAS 33125-86-9) is a chemical compound with molecular formula C10H20Cl4O8P2 and molecular weight 469.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-chloroethoxy)phosphoryloxy]ethyl bis(2-chloroethyl) phosphate
Also Known As: THERMOLIN 101, Ethylene bis(bis(2-chloroethyl)phosphate), tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate), Phosphoric acid, 1,2-ethanediyl tetrakis(2-chloroethyl) ester, Tetrakis(2-chloroethyl)ethylene diphosphate
| Molecular Formula | C10H20Cl4O8P2 |
|---|---|
| Molecular Weight | 469.94 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 471.9358 |
| Heavy Atoms | 24 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 33125-86-9 |
|---|---|
| SMILES | C(COP(=O)(OCCCl)OCCCl)OP(=O)(OCCCl)OCCCl |
| InChIKey | CJWBPEYRTPGWPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) (CAS 33125-86-9), with molecular formula C10H20Cl4O8P2 and molecular weight 469.94 g/mol. IUPAC: 2-[bis(2-chloroethoxy)phosphoryloxy]ethyl bis(2-chloroethyl) phosphate.
Chemical Property Profile of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)
Property Insights of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate). The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate). Following Lipinski's Rule of Five, Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) has 0 hydrogen bond donor(s) and 8 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 Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)?
The CAS number of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) is 33125-86-9.
What is the molecular formula of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)?
The molecular formula of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) is C10H20Cl4O8P2.
What is the molecular weight of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)?
The molecular weight of Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) is 469.94 g/mol.
Where can I buy Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)?
You can request a quote for Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)?
Yes, KEHONG BIO provides custom synthesis services for Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.