1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride
TL;DR: 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride (CAS 52801-93-1) is a chemical compound with molecular formula C5H12Cl3N and molecular weight 191.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-chloroethyl)propan-1-amine;hydrochloride
Also Known As: (2-CHLOROETHYL)(2-CHLOROPROPYL)AMINE HYDROCHLORIDE, 2-Chloro-N-(2-chloroethyl)-1-propanamine hydrochloride, 2-chloro-N-(2-chloroethyl)propan-1-amine;hydrochloride, 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride, 1-Propanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride
| Molecular Formula | C5H12Cl3N |
|---|---|
| Molecular Weight | 191.00 g/mol |
| LogP | 1.8639 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.00352 |
| Heavy Atoms | 9 |
| Complexity | 49.467766 |
Chemical Identifiers
| CAS Number | 52801-93-1 |
|---|---|
| SMILES | CC(CNCCCl)Cl.Cl |
Product Overview
1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride (CAS 52801-93-1), with molecular formula C5H12Cl3N and molecular weight 191.00 g/mol. IUPAC: 2-chloro-N-(2-chloroethyl)propan-1-amine;hydrochloride.
Chemical Property Profile of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride
Property Insights of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride
The XLogP value of 1.8639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride. With a topological polar surface area (TPSA) of 12.03 Ų, 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, 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
Frequently Asked Questions
What is the CAS number of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride?
The CAS number of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride is 52801-93-1.
What is the molecular formula of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride?
The molecular formula of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride is C5H12Cl3N.
What is the molecular weight of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride?
The molecular weight of 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride is 191.00 g/mol.
Where can I buy 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride?
You can request a quote for 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Propylamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.