Disulfide, bis(2-chloroethyl)
TL;DR: Disulfide, bis(2-chloroethyl) (CAS 1002-41-1) is a chemical compound with molecular formula C4H8Cl2S2 and molecular weight 189.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-(2-chloroethyldisulfanyl)ethane
Also Known As: Disulfide, bis(2-chloroethyl), 1,2-Bis(2-chloroethyl)disulfane, Mustard disulfide, Bis(2-chloroethyl) disulfide, bis(2-chloroethyl)disulfide
| Molecular Formula | C4H8Cl2S2 |
|---|---|
| Molecular Weight | 189.94 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 189.94444 |
| Heavy Atoms | 8 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 1002-41-1 |
|---|---|
| SMILES | C(CCl)SSCCCl |
| InChIKey | XDFZUXHZXUFQOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Disulfide, bis(2-chloroethyl) (CAS 1002-41-1), with molecular formula C4H8Cl2S2 and molecular weight 189.94 g/mol. IUPAC: 1-chloro-2-(2-chloroethyldisulfanyl)ethane.
Chemical Property Profile of Disulfide, bis(2-chloroethyl)
Property Insights of Disulfide, bis(2-chloroethyl)
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Disulfide, bis(2-chloroethyl). With a topological polar surface area (TPSA) of 50.6 Ų, Disulfide, bis(2-chloroethyl) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Disulfide, bis(2-chloroethyl) has 0 hydrogen bond donor(s) and 2 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 Disulfide, bis(2-chloroethyl)?
The CAS number of Disulfide, bis(2-chloroethyl) is 1002-41-1.
What is the molecular formula of Disulfide, bis(2-chloroethyl)?
The molecular formula of Disulfide, bis(2-chloroethyl) is C4H8Cl2S2.
What is the molecular weight of Disulfide, bis(2-chloroethyl)?
The molecular weight of Disulfide, bis(2-chloroethyl) is 189.94 g/mol.
Where can I buy Disulfide, bis(2-chloroethyl)?
You can request a quote for Disulfide, bis(2-chloroethyl) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disulfide, bis(2-chloroethyl)?
Yes, KEHONG BIO provides custom synthesis services for Disulfide, bis(2-chloroethyl) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.