1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)
TL;DR: 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) (CAS 13078-45-0) is a chemical compound with molecular formula C8H16Cl2O4 and molecular weight 246.04257 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-3-[2-(3-chloro-2-hydroxypropoxy)ethoxy]propan-2-ol
Also Known As: 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol), KST-1B3916, 1-chloro-3-[2-(3-chloro-2-hydroxypropoxy)ethoxy]propan-2-ol, 1,1'-(Ethylenedioxy)bis(3-chloro-2-propanol), 1,1/'-(Ethylenedioxy)bis(3-chloropropan-2-ol)
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H16Cl2O4 |
| Molecular Weight | 246.04257 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 246.04257 Da |
| Heavy Atoms | 14 |
| Complexity | 112.0 |
| SMILES | C(COCC(CCl)O)OCC(CCl)O |
| InChIKey | MEBAOCKWPXDTDB-UHFFFAOYSA-N |
Chemical Property Profile of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)
Property Insights of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)
The XLogP value of -0.1 indicates that 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.9 Ų, 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) 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
What is the CAS number of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)?
The CAS number of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) is 13078-45-0.
What is the molecular formula of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)?
The molecular formula of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) is C8H16Cl2O4.
What is the molecular weight of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)?
The molecular weight of 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) is 246.04257 g/mol.
Where can I buy 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)?
You can request a quote for 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)?
Yes, CoreyChem provides custom synthesis services for 1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.