2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride
TL;DR: 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride (CAS 1052415-08-3) is a chemical compound with molecular formula C13H19ClFNO2 and molecular weight 275.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 3-fluorobenzoate;hydrochloride
Also Known As: 2-diethylaminoethyl 3-fluorobenzoate Hydrochloride, 2-(DIETHYLAMINO)ETHYL 3-FLUOROBENZOATE HYDROCHLORIDE
| Molecular Formula | C13H19ClFNO2 |
|---|---|
| Molecular Weight | 275.11 g/mol |
| LogP | 2.7461 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.10883 |
| Heavy Atoms | 18 |
| Complexity | 369.7638 |
Chemical Identifiers
| CAS Number | 1052415-08-3 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC(=CC=C1)F.Cl |
Product Overview
2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride (CAS 1052415-08-3), with molecular formula C13H19ClFNO2 and molecular weight 275.11 g/mol. IUPAC: 2-(diethylamino)ethyl 3-fluorobenzoate;hydrochloride.
Chemical Property Profile of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride
Property Insights of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride
The XLogP value of 2.7461 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride. With a topological polar surface area (TPSA) of 29.54 Ų, 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride has 0 hydrogen bond donor(s) and 3 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-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride?
The CAS number of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride is 1052415-08-3.
What is the molecular formula of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride?
The molecular formula of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride is C13H19ClFNO2.
What is the molecular weight of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride?
The molecular weight of 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride is 275.11 g/mol.
Where can I buy 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride?
You can request a quote for 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)ethyl 3-fluorobenzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.