1-(Diethylamino)propan-2-yl 2-fluorobenzoate
TL;DR: 1-(Diethylamino)propan-2-yl 2-fluorobenzoate (CAS 733012-38-9) is a chemical compound with molecular formula C14H20FNO2 and molecular weight 253.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diethylamino)propan-2-yl 2-fluorobenzoate
Also Known As: 1-(diethylamino)propan-2-yl 2-fluorobenzoate, 1-diethylaminopropan-2-yl 2-fluorobenzoate, AB01276778-01
| Molecular Formula | C14H20FNO2 |
|---|---|
| Molecular Weight | 253.15 g/mol |
| LogP | 2.7128 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.14781 |
| Heavy Atoms | 18 |
| Complexity | 391.1353 |
Chemical Identifiers
| CAS Number | 733012-38-9 |
|---|---|
| SMILES | CCN(CC)CC(C)OC(=O)C1=CC=CC=C1F |
Product Overview
1-(Diethylamino)propan-2-yl 2-fluorobenzoate (CAS 733012-38-9), with molecular formula C14H20FNO2 and molecular weight 253.15 g/mol. IUPAC: 1-(diethylamino)propan-2-yl 2-fluorobenzoate.
Chemical Property Profile of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate
Property Insights of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate
The XLogP value of 2.7128 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Diethylamino)propan-2-yl 2-fluorobenzoate. With a topological polar surface area (TPSA) of 29.54 Ų, 1-(Diethylamino)propan-2-yl 2-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Diethylamino)propan-2-yl 2-fluorobenzoate 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 1-(Diethylamino)propan-2-yl 2-fluorobenzoate?
The CAS number of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate is 733012-38-9.
What is the molecular formula of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate?
The molecular formula of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate is C14H20FNO2.
What is the molecular weight of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate?
The molecular weight of 1-(Diethylamino)propan-2-yl 2-fluorobenzoate is 253.15 g/mol.
Where can I buy 1-(Diethylamino)propan-2-yl 2-fluorobenzoate?
You can request a quote for 1-(Diethylamino)propan-2-yl 2-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Diethylamino)propan-2-yl 2-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 1-(Diethylamino)propan-2-yl 2-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.