Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-
TL;DR: Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- (CAS 122855-07-6) is a chemical compound with molecular formula C13H11ClFNO and molecular weight 251.05132 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2-fluoro-5-phenylmethoxyaniline
Also Known As: 4-chloro-2-fluoro-5-phenylmethoxyaniline, Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-, 2-Fluoro-4-chloro-5-benzyloxyaniline, 4-Chloro-2-fluoro-5-(phenylmethoxy)aniline, 4-chloro-2-fluoro-5-phenylmethoxy-aniline
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H11ClFNO |
| Molecular Weight | 251.05132 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.05132 Da |
| Heavy Atoms | 17 |
| Complexity | 235.0 |
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C(=C2)N)F)Cl |
| InChIKey | UBCLWRBMYPPSFE-UHFFFAOYSA-N |
Chemical Property Profile of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-
Property Insights of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-
The XLogP value of 3.4 indicates that Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.3 Ų, Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-?
The CAS number of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- is 122855-07-6.
What is the molecular formula of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-?
The molecular formula of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- is C13H11ClFNO.
What is the molecular weight of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-?
The molecular weight of Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- is 251.05132 g/mol.
Where can I buy Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-?
You can request a quote for Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)-?
Yes, CoreyChem provides custom synthesis services for Aniline, 4-chloro-2-fluoro-5-(phenylmethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.