1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)
TL;DR: 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) (CAS 102367-11-3) is a chemical compound with molecular formula C10H20Cl3N and molecular weight 259.06613 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butyl-2,5-bis(chloromethyl)pyrrolidine;hydrochloride
Also Known As: 2,5-Bis(chloromethyl)-1-butylpyrrolidine hydrochloride, 1-butyl-2,5-bis(chloromethyl)pyrrolidine hydrochloride, Pyrrolidine, 2,5-bis(chloromethyl)-1-butyl-, hydrochloride, 1-butyl-2,5-bis(chloromethyl)pyrrolidine,hydrochloride, 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C10H20Cl3N |
| Molecular Weight | 259.06613 g/mol |
| XLogP | 3.5189 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.06613 Da |
| Heavy Atoms | 14 |
| Complexity | 129.0 |
| SMILES | CCCCN1C(CCC1CCl)CCl.Cl |
| InChIKey | INDPEWVBGZJOOB-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)
Property Insights of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)
The XLogP value of 3.5189 indicates that 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) 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 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)?
The CAS number of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) is 102367-11-3.
What is the molecular formula of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)?
The molecular formula of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) is C10H20Cl3N.
What is the molecular weight of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)?
The molecular weight of 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) is 259.06613 g/mol.
Where can I buy 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)?
You can request a quote for 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1)?
Yes, CoreyChem provides custom synthesis services for 1-Butyl-2,5-bis(chloromethyl)pyrrolidine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.