3-chloro-N-(2-chloroethyl)propan-1-amine
TL;DR: 3-chloro-N-(2-chloroethyl)propan-1-amine (CAS 42453-19-0) is a chemical compound with molecular formula C5H11Cl2N and molecular weight 155.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(2-chloroethyl)propan-1-amine
Also Known As: Ifosfamide Impurity E, Ifosfamide EP Impurity E, 3-chloro-N-(2-chloroethyl)propan-1-amine, (2-chloroethyl)(3-chloropropyl)amine, Ifosfamide impurity E CRS
| Molecular Formula | C5H11Cl2N |
|---|---|
| Molecular Weight | 155.03 g/mol |
| LogP | 1.4437 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 155.02686 |
| Heavy Atoms | 8 |
| Complexity | 35.40991 |
Chemical Identifiers
| CAS Number | 42453-19-0 |
|---|---|
| SMILES | C(CNCCCl)CCl |
Product Overview
3-chloro-N-(2-chloroethyl)propan-1-amine (CAS 42453-19-0), with molecular formula C5H11Cl2N and molecular weight 155.03 g/mol. IUPAC: 3-chloro-N-(2-chloroethyl)propan-1-amine.
Chemical Property Profile of 3-chloro-N-(2-chloroethyl)propan-1-amine
Property Insights of 3-chloro-N-(2-chloroethyl)propan-1-amine
The XLogP value of 1.4437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-N-(2-chloroethyl)propan-1-amine. With a topological polar surface area (TPSA) of 12.03 Ų, 3-chloro-N-(2-chloroethyl)propan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(2-chloroethyl)propan-1-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 3-chloro-N-(2-chloroethyl)propan-1-amine?
The CAS number of 3-chloro-N-(2-chloroethyl)propan-1-amine is 42453-19-0.
What is the molecular formula of 3-chloro-N-(2-chloroethyl)propan-1-amine?
The molecular formula of 3-chloro-N-(2-chloroethyl)propan-1-amine is C5H11Cl2N.
What is the molecular weight of 3-chloro-N-(2-chloroethyl)propan-1-amine?
The molecular weight of 3-chloro-N-(2-chloroethyl)propan-1-amine is 155.03 g/mol.
Where can I buy 3-chloro-N-(2-chloroethyl)propan-1-amine?
You can request a quote for 3-chloro-N-(2-chloroethyl)propan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(2-chloroethyl)propan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(2-chloroethyl)propan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.