2,3-Bis(sulfanyl)propyl 2-chlorobenzoate
TL;DR: 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate (CAS 103040-47-7) is a chemical compound with molecular formula C10H11ClO2S2 and molecular weight 261.9889 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-bis(sulfanyl)propyl 2-chlorobenzoate
Also Known As: Disulfanyl deriv., BRL 636, 2,3-Dimercaptopropyl o-chlorobenzoate, 2,3-bis(sulfanyl)propyl 2-chlorobenzoate, 2,3-Disulfanylpropyl 2-chlorobenzoate
Technical Specifications
| Molecular Formula | C10H11ClO2S2 |
| Molecular Weight | 261.9889 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 28.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.9889 Da |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)OCC(CS)S)Cl |
| InChIKey | XIPKRINXYWZRFY-UHFFFAOYSA-N |
Chemical Property Profile of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate
Property Insights of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate
The XLogP value of 3.0 indicates that 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.3 Ų, 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate 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 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate?
The CAS number of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate is 103040-47-7.
What is the molecular formula of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate?
The molecular formula of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate is C10H11ClO2S2.
What is the molecular weight of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate?
The molecular weight of 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate is 261.9889 g/mol.
Where can I buy 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate?
You can request a quote for 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate?
Yes, CoreyChem provides custom synthesis services for 2,3-Bis(sulfanyl)propyl 2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.