3-Chloro-5-fluoro-4-methoxybenzaldehyde
TL;DR: 3-Chloro-5-fluoro-4-methoxybenzaldehyde (CAS 177994-49-9) is a chemical compound with molecular formula C8H6ClFO2 and molecular weight 188.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5-fluoro-4-methoxybenzaldehyde
Also Known As: 3-Chloro-5-fluoro-4-methoxybenzaldehyde, Benzaldehyde, 3-chloro-5-fluoro-4-methoxy-, 3-chloro-5-fluoro-4-methoxy-benzaldehyde, Benzaldehyde,3-chloro-5-fluoro-4-methoxy-, 3-Fluoro-5-chloro-4-methoxybenzaldehyde
| Molecular Formula | C8H6ClFO2 |
|---|---|
| Molecular Weight | 188.00 g/mol |
| LogP | 2.3002 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.00403 |
| Heavy Atoms | 12 |
| Complexity | 288.92133 |
Chemical Identifiers
| CAS Number | 177994-49-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1Cl)C=O)F |
Product Overview
3-Chloro-5-fluoro-4-methoxybenzaldehyde (CAS 177994-49-9), with molecular formula C8H6ClFO2 and molecular weight 188.00 g/mol. IUPAC: 3-chloro-5-fluoro-4-methoxybenzaldehyde.
Chemical Property Profile of 3-Chloro-5-fluoro-4-methoxybenzaldehyde
Property Insights of 3-Chloro-5-fluoro-4-methoxybenzaldehyde
The XLogP value of 2.3002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-5-fluoro-4-methoxybenzaldehyde. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Chloro-5-fluoro-4-methoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-5-fluoro-4-methoxybenzaldehyde 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-Chloro-5-fluoro-4-methoxybenzaldehyde?
The CAS number of 3-Chloro-5-fluoro-4-methoxybenzaldehyde is 177994-49-9.
What is the molecular formula of 3-Chloro-5-fluoro-4-methoxybenzaldehyde?
The molecular formula of 3-Chloro-5-fluoro-4-methoxybenzaldehyde is C8H6ClFO2.
What is the molecular weight of 3-Chloro-5-fluoro-4-methoxybenzaldehyde?
The molecular weight of 3-Chloro-5-fluoro-4-methoxybenzaldehyde is 188.00 g/mol.
Where can I buy 3-Chloro-5-fluoro-4-methoxybenzaldehyde?
You can request a quote for 3-Chloro-5-fluoro-4-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-5-fluoro-4-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-5-fluoro-4-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.