4-(Bis(2-fluoroethyl)amino)benzaldehyde
TL;DR: 4-(Bis(2-fluoroethyl)amino)benzaldehyde (CAS 1208-04-4) is a chemical compound with molecular formula C11H13F2NO and molecular weight 213.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-fluoroethyl)amino]benzaldehyde
Also Known As: 4-[bis(2-fluoroethyl)amino]benzaldehyde, Benzaldehyde, p-(bis(2-fluoroethyl)amino)-, NCIOpen2_004896, p-(Bis(2-fluoroethyl)amino)benzaldehyde, 4-(Bis(2-fluoroethyl)amino)benzaldehyde
| Molecular Formula | C11H13F2NO |
|---|---|
| Molecular Weight | 213.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 213.09653 |
| Heavy Atoms | 15 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 1208-04-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C=O)N(CCF)CCF |
| InChIKey | CAEWGNXPCYMVCH-UHFFFAOYSA-N |
Product Overview
4-(Bis(2-fluoroethyl)amino)benzaldehyde (CAS 1208-04-4), with molecular formula C11H13F2NO and molecular weight 213.10 g/mol. IUPAC: 4-[bis(2-fluoroethyl)amino]benzaldehyde.
Chemical Property Profile of 4-(Bis(2-fluoroethyl)amino)benzaldehyde
Property Insights of 4-(Bis(2-fluoroethyl)amino)benzaldehyde
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Bis(2-fluoroethyl)amino)benzaldehyde. With a topological polar surface area (TPSA) of 20.3 Ų, 4-(Bis(2-fluoroethyl)amino)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Bis(2-fluoroethyl)amino)benzaldehyde has 0 hydrogen bond donor(s) and 4 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 4-(Bis(2-fluoroethyl)amino)benzaldehyde?
The CAS number of 4-(Bis(2-fluoroethyl)amino)benzaldehyde is 1208-04-4.
What is the molecular formula of 4-(Bis(2-fluoroethyl)amino)benzaldehyde?
The molecular formula of 4-(Bis(2-fluoroethyl)amino)benzaldehyde is C11H13F2NO.
What is the molecular weight of 4-(Bis(2-fluoroethyl)amino)benzaldehyde?
The molecular weight of 4-(Bis(2-fluoroethyl)amino)benzaldehyde is 213.10 g/mol.
Where can I buy 4-(Bis(2-fluoroethyl)amino)benzaldehyde?
You can request a quote for 4-(Bis(2-fluoroethyl)amino)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Bis(2-fluoroethyl)amino)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Bis(2-fluoroethyl)amino)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.