4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde
TL;DR: 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde (CAS 105802-45-7) is a chemical compound with molecular formula C10H6ClFO2 and molecular weight 212.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-6-fluoro-2H-chromene-3-carbaldehyde
Also Known As: 4-chloro-6-fluoro-2H-chromene-3-carbaldehyde, 4-Chloro-6-fluoro-2H-benzopyran-3-carboxaldehyde, 4-Fluoro-2-(trifluoromethyl)benzamide, 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde, 4-chloro-6-fluoro-2H-1-benzopyran-3-carboxaldehyde
| Molecular Formula | C10H6ClFO2 |
|---|---|
| Molecular Weight | 212.00 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.00403 |
| Heavy Atoms | 14 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 105802-45-7 |
|---|---|
| SMILES | C1C(=C(C2=C(O1)C=CC(=C2)F)Cl)C=O |
| InChIKey | RBLLNXBYFXPIPW-UHFFFAOYSA-N |
Product Overview
4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde (CAS 105802-45-7), with molecular formula C10H6ClFO2 and molecular weight 212.00 g/mol. IUPAC: 4-chloro-6-fluoro-2H-chromene-3-carbaldehyde.
Chemical Property Profile of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde
Property Insights of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde has 0 hydrogen bond donor(s) and 3 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-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde?
The CAS number of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde is 105802-45-7.
What is the molecular formula of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde?
The molecular formula of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde is C10H6ClFO2.
What is the molecular weight of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde?
The molecular weight of 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde is 212.00 g/mol.
Where can I buy 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde?
You can request a quote for 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-6-fluoro-2H-1-benzopyran-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.