1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol
TL;DR: 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol (CAS 88991-19-9) is a chemical compound with molecular formula C4H9Cl3O4 and molecular weight 225.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethane-1,2-diol;2,2,2-trichloroethane-1,1-diol
Also Known As: Perzotox, 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol, 2,2,2-Trichloro-1,1-ethanediol mixt. with 1,2-ethanediol, ethane-1,2-diol; 2,2,2-trichloroethane-1,1-diol, Ethane-1,2-diol--2,2,2-trichloroethane-1,1-diol (1/1)
| Molecular Formula | C4H9Cl3O4 |
|---|---|
| Molecular Weight | 225.96 g/mol |
| LogP | -0.3617 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.95663 |
| Heavy Atoms | 11 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 88991-19-9 |
|---|---|
| SMILES | C(CO)O.C(C(Cl)(Cl)Cl)(O)O |
| InChIKey | KNWKQPFSUXOXJV-UHFFFAOYSA-N |
Product Overview
1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol (CAS 88991-19-9), with molecular formula C4H9Cl3O4 and molecular weight 225.96 g/mol. IUPAC: ethane-1,2-diol;2,2,2-trichloroethane-1,1-diol.
Chemical Property Profile of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol
Property Insights of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol
The XLogP value of -0.3617 indicates that 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol. Following Lipinski's Rule of Five, 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol has 4 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 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol?
The CAS number of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol is 88991-19-9.
What is the molecular formula of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol?
The molecular formula of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol is C4H9Cl3O4.
What is the molecular weight of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol?
The molecular weight of 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol is 225.96 g/mol.
Where can I buy 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol?
You can request a quote for 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Ethanediol, 2,2,2-trichloro-, mixt. with 1,2-ethanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.