氯丙醇
TL;DR: 氯丙醇 (CAS 3563-58-4) is a chemical compound with molecular formula C8H15Cl3O3 and molecular weight 264.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯丙醇
2-methyl-4-(2,2,2-trichloro-1-hydroxyethoxy)pentan-2-ol
Also Known As: Chloralodol, CHLORHEXADOL, Mecoral, Lora, Cloralodol
| Molecular Formula | C8H15Cl3O3 |
|---|---|
| Molecular Weight | 264.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.00867 |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
| Melting Point | 103 |
| Boiling Point | 304.7°Cat760mmHg |
Chemical Identifiers
| CAS Number | 3563-58-4 |
|---|---|
| SMILES | CC(CC(C)(C)O)OC(C(Cl)(Cl)Cl)O |
| InChIKey | QVFWZNCVPCJQOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯丙醇 (CAS 3563-58-4), with molecular formula C8H15Cl3O3 and molecular weight 264.01 g/mol. IUPAC: 2-methyl-4-(2,2,2-trichloro-1-hydroxyethoxy)pentan-2-ol.
Chemical Property Profile of 氯丙醇
Property Insights of 氯丙醇
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯丙醇. With a topological polar surface area (TPSA) of 49.7 Ų, 氯丙醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯丙醇 has 2 hydrogen bond donor(s) and 3 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 氯丙醇?
The CAS number of 氯丙醇 is 3563-58-4.
What is the molecular formula of 氯丙醇?
The molecular formula of 氯丙醇 is C8H15Cl3O3.
What is the molecular weight of 氯丙醇?
The molecular weight of 氯丙醇 is 264.01 g/mol.
Where can I buy 氯丙醇?
You can request a quote for 氯丙醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯丙醇?
Yes, KEHONG BIO provides custom synthesis services for 氯丙醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.