3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone
TL;DR: 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone (CAS 123685-69-8) is a chemical compound with molecular formula C13H18FNO and molecular weight 223.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)-1-(4-fluorophenyl)propan-1-one
Also Known As: TimTec1_008455, BAS 01123800, 3-(Diethylamino)-4'-fluoropropiophenone, 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone, 3-(diethylamino)-1-(4-fluorophenyl)propan-1-one
| Molecular Formula | C13H18FNO |
|---|---|
| Molecular Weight | 223.14 g/mol |
| LogP | 2.7403 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.13724 |
| Heavy Atoms | 16 |
| Complexity | 330.29077 |
Chemical Identifiers
| CAS Number | 123685-69-8 |
|---|---|
| SMILES | CCN(CC)CCC(=O)C1=CC=C(C=C1)F |
Product Overview
3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone (CAS 123685-69-8), with molecular formula C13H18FNO and molecular weight 223.14 g/mol. IUPAC: 3-(diethylamino)-1-(4-fluorophenyl)propan-1-one.
Chemical Property Profile of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone
Property Insights of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone
The XLogP value of 2.7403 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone. With a topological polar surface area (TPSA) of 20.31 Ų, 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone has 0 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 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone?
The CAS number of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone is 123685-69-8.
What is the molecular formula of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone?
The molecular formula of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone is C13H18FNO.
What is the molecular weight of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone?
The molecular weight of 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone is 223.14 g/mol.
Where can I buy 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone?
You can request a quote for 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 3-(Diethylamino)-1-(4-fluorophenyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.