2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine
TL;DR: 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine (CAS 99221-76-8) is a chemical compound with molecular formula C5H8ClN3 and molecular weight 145.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-1H-imidazol-5-yl)ethanamine
Also Known As: 4-Chlorohistamine, 5-Chlorohistamine, Histamine, 4-chloro-, Histamine, 5-chloro-, 2-(5-CHLORO-1H-IMIDAZOL-4-YL)ETHAN-1-AMINE
| Molecular Formula | C5H8ClN3 |
|---|---|
| Molecular Weight | 145.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 145.04068 |
| Heavy Atoms | 9 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 99221-76-8 |
|---|---|
| SMILES | C1=NC(=C(N1)CCN)Cl |
| InChIKey | RMRXSWXCXDHSBA-UHFFFAOYSA-N |
Product Overview
2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine (CAS 99221-76-8), with molecular formula C5H8ClN3 and molecular weight 145.04 g/mol. IUPAC: 2-(4-chloro-1H-imidazol-5-yl)ethanamine.
Chemical Property Profile of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine
Property Insights of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine. With a topological polar surface area (TPSA) of 54.7 Ų, 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine has 2 hydrogen bond donor(s) and 2 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 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine?
The CAS number of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine is 99221-76-8.
What is the molecular formula of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine?
The molecular formula of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine is C5H8ClN3.
What is the molecular weight of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine?
The molecular weight of 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine is 145.04 g/mol.
Where can I buy 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine?
You can request a quote for 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Chloro-1H-imidazol-4-YL)ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.