![3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol structure](/static/products/4679/46795-37-3.webp)
3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol
TL;DR: 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol (CAS 46795-37-3) is a chemical compound with molecular formula C9H7Cl5O2S and molecular weight 353.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3,4,5,6-pentachlorophenyl)sulfanylpropane-1,2-diol
Also Known As: 3-[(pentachlorophenyl)sulfanyl]propane-1,2-diol, 3-(2,3,4,5,6-pentachlorophenyl)sulfanylpropane-1,2-diol
| Molecular Formula | C9H7Cl5O2S |
|---|---|
| Molecular Weight | 353.86 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.86093 |
| Heavy Atoms | 17 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 46795-37-3 |
|---|---|
| SMILES | C(C(CSC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O)O |
| InChIKey | VEPQCBJMHQPVLE-UHFFFAOYSA-N |
Product Overview
3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol (CAS 46795-37-3), with molecular formula C9H7Cl5O2S and molecular weight 353.86 g/mol. IUPAC: 3-(2,3,4,5,6-pentachlorophenyl)sulfanylpropane-1,2-diol.
Chemical Property Profile of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol
Property Insights of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol
The XLogP value of 4.3 indicates that 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol. Following Lipinski's Rule of Five, 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol 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 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol?
The CAS number of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol is 46795-37-3.
What is the molecular formula of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol?
The molecular formula of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol is C9H7Cl5O2S.
What is the molecular weight of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol?
The molecular weight of 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol is 353.86 g/mol.
Where can I buy 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol?
You can request a quote for 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Pentachlorophenyl)sulfanyl]propane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.