Bis(3-chloropropyl)amine
TL;DR: Bis(3-chloropropyl)amine (CAS 102073-95-0) is a chemical compound with molecular formula C6H13Cl2N and molecular weight 169.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(3-chloropropyl)propan-1-amine
Also Known As: Bis(3-chloropropyl)amine, Urapidil Impurity 37, di(3-chloropropyl)amine, 3-chloro-N-(3-chloropropyl)propan-1-amine, 1-Propanamine, 3-chloro-N-(3-chloropropyl)-
| Molecular Formula | C6H13Cl2N |
|---|---|
| Molecular Weight | 169.04 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 169.04251 |
| Heavy Atoms | 9 |
| Complexity | 44.0 |
Chemical Identifiers
| CAS Number | 102073-95-0 |
|---|---|
| SMILES | C(CNCCCCl)CCl |
| InChIKey | VOUJQKYOLXSFCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bis(3-chloropropyl)amine (CAS 102073-95-0), with molecular formula C6H13Cl2N and molecular weight 169.04 g/mol. IUPAC: 3-chloro-N-(3-chloropropyl)propan-1-amine.
Chemical Property Profile of Bis(3-chloropropyl)amine
Property Insights of Bis(3-chloropropyl)amine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(3-chloropropyl)amine. With a topological polar surface area (TPSA) of 12.0 Ų, Bis(3-chloropropyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(3-chloropropyl)amine 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 Bis(3-chloropropyl)amine?
The CAS number of Bis(3-chloropropyl)amine is 102073-95-0.
What is the molecular formula of Bis(3-chloropropyl)amine?
The molecular formula of Bis(3-chloropropyl)amine is C6H13Cl2N.
What is the molecular weight of Bis(3-chloropropyl)amine?
The molecular weight of Bis(3-chloropropyl)amine is 169.04 g/mol.
Where can I buy Bis(3-chloropropyl)amine?
You can request a quote for Bis(3-chloropropyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(3-chloropropyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Bis(3-chloropropyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.