N-(2-氯乙基)-2-氟乙胺
TL;DR: N-(2-氯乙基)-2-氟乙胺 (CAS 44613-47-0) is a chemical compound with molecular formula C4H9ClFN and molecular weight 125.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-氯乙基)-2-氟乙胺
N-(2-chloroethyl)-2-fluoroethanamine
Also Known As: N-(2-chloroethyl)-2-fluoroethanamine, N-(2-chloroethyl)-N-(2-fluoroethyl)amine, 2-Chloro-2'-fluorodiethylamine hydrochloride, DIETHYLAMINE, 2-CHLORO-2'-FLUORO-, HYDROCHLORIDE, Ethanamine, N-(2-chloroethyl)-2-fluoro-, hydrochloride
| Molecular Formula | C4H9ClFN |
|---|---|
| Molecular Weight | 125.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 125.04076 |
| Heavy Atoms | 7 |
| Complexity | 34.0 |
Chemical Identifiers
| CAS Number | 44613-47-0 |
|---|---|
| SMILES | C(CF)NCCCl |
| InChIKey | ZSMBQQOVUWZPDN-UHFFFAOYSA-N |
Product Overview
N-(2-氯乙基)-2-氟乙胺 (CAS 44613-47-0), with molecular formula C4H9ClFN and molecular weight 125.04 g/mol. IUPAC: N-(2-chloroethyl)-2-fluoroethanamine.
Chemical Property Profile of N-(2-氯乙基)-2-氟乙胺
Property Insights of N-(2-氯乙基)-2-氟乙胺
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-氯乙基)-2-氟乙胺. With a topological polar surface area (TPSA) of 12.0 Ų, N-(2-氯乙基)-2-氟乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-氯乙基)-2-氟乙胺 has 1 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 N-(2-氯乙基)-2-氟乙胺?
The CAS number of N-(2-氯乙基)-2-氟乙胺 is 44613-47-0.
What is the molecular formula of N-(2-氯乙基)-2-氟乙胺?
The molecular formula of N-(2-氯乙基)-2-氟乙胺 is C4H9ClFN.
What is the molecular weight of N-(2-氯乙基)-2-氟乙胺?
The molecular weight of N-(2-氯乙基)-2-氟乙胺 is 125.04 g/mol.
Where can I buy N-(2-氯乙基)-2-氟乙胺?
You can request a quote for N-(2-氯乙基)-2-氟乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-氯乙基)-2-氟乙胺?
Yes, KEHONG BIO provides custom synthesis services for N-(2-氯乙基)-2-氟乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.