Mechlorethamine Oxide Hydrochloride
TL;DR: Mechlorethamine Oxide Hydrochloride (CAS 302-70-5) is a chemical compound with molecular formula C5H12Cl3NO and molecular weight 206.99844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-(2-chloroethyl)-N-methylethanamine oxide;hydrochloride
Also Known As: Nitromin, Mitomen, Mustron, Oxyamine, Ossichlorin
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H12Cl3NO |
| Molecular Weight | 206.99844 g/mol |
| XLogP | 1.83 |
| Topological Polar Surface Area (TPSA) | 18.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.99844 Da |
| Heavy Atoms | 10 |
| Complexity | 73.0 |
| Melting Point | 109-110 °C |
| Solubility | Sol in water |
| SMILES | C[N+](CCCl)(CCCl)[O-].Cl |
| InChIKey | SYNHCENRCUAUNM-UHFFFAOYSA-N |
Product Description
Applications: Mechlorethamine Oxide Hydrochloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as an oxidizing agent in synthetic sequences. CoreyChem supplies Mechlorethamine Oxide Hydrochloride (CAS 302-70-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Mechlorethamine Oxide Hydrochloride (CAS 302-70-5) has the molecular formula C5H12Cl3NO and a molecular weight of 207 g/mol. Reported properties include a solubility: Sol in water. It is also known as Nitromin and Mitomen.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Mechlorethamine Oxide Hydrochloride
Property Insights of Mechlorethamine Oxide Hydrochloride
The XLogP value of 1.83 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mechlorethamine Oxide Hydrochloride. With a topological polar surface area (TPSA) of 18.1 Ų, Mechlorethamine Oxide Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mechlorethamine Oxide Hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Mechlorethamine Oxide Hydrochloride?
The CAS number of Mechlorethamine Oxide Hydrochloride is 302-70-5.
What is the molecular formula of Mechlorethamine Oxide Hydrochloride?
The molecular formula of Mechlorethamine Oxide Hydrochloride is C5H12Cl3NO.
What is the molecular weight of Mechlorethamine Oxide Hydrochloride?
The molecular weight of Mechlorethamine Oxide Hydrochloride is 206.99844 g/mol.
What are the applications of Mechlorethamine Oxide Hydrochloride?
Mechlorethamine Oxide Hydrochloride is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as an oxidizing agent in synthetic sequences. CoreyChem supplies Mechlorethamine Oxide...
Where can I buy Mechlorethamine Oxide Hydrochloride?
You can request a quote for Mechlorethamine Oxide Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mechlorethamine Oxide Hydrochloride?
Yes, CoreyChem provides custom synthesis services for Mechlorethamine Oxide Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.