Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-
TL;DR: Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- (CAS 4092-85-7) is a chemical compound with molecular formula C14H19ClFNO2 and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]butanoic acid
Also Known As: NCIOpen2_004976, BUTYRIC ACID, 4-(p-((2-CHLOROETHYL)(2-FLUOROETHYL)AMINO)PHENYL)-, 4-(p-((2-Chloroethyl)(2-fluoroethyl)amino)phenyl)butyric acid, 4-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]butanoic acid, 4-[p-[(2-Chloroethyl)(2-fluoroethyl)amino]phenyl]butyric acid
| Molecular Formula | C14H19ClFNO2 |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 287.10883 |
| Heavy Atoms | 19 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 4092-85-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCC(=O)O)N(CCF)CCCl |
| InChIKey | OWBUABLEZFMTMG-UHFFFAOYSA-N |
Product Overview
Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- (CAS 4092-85-7), with molecular formula C14H19ClFNO2 and molecular weight 287.11 g/mol. IUPAC: 4-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]butanoic acid.
Chemical Property Profile of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-
Property Insights of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-. With a topological polar surface area (TPSA) of 40.5 Ų, Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- has 1 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 Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-?
The CAS number of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- is 4092-85-7.
What is the molecular formula of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-?
The molecular formula of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- is C14H19ClFNO2.
What is the molecular weight of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-?
The molecular weight of Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- is 287.11 g/mol.
Where can I buy Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-?
You can request a quote for Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 4-(p-((2-chloroethyl)(2-fluoroethyl)amino)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.