4-chloro-6-fluoro-2H-chromene-3-carbonitrile
TL;DR: 4-chloro-6-fluoro-2H-chromene-3-carbonitrile (CAS 175205-57-9) is a chemical compound with molecular formula C10H5ClFNO and molecular weight 209.00 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-carbonitrile
Also Known As: 4-chloro-6-fluoro-2H-chromene-3-carbonitrile, 4-Chloro-3-cyano-6-fluoro-2H-benzopyran, 2H-1-Benzopyran-3-carbonitrile, 4-chloro-6-fluoro-, 4-chloro-6-fluoro-2H-1-benzopyran-3-carbonitrile, 2H-1-Benzopyran-3-carbonitrile,4-chloro-6-fluoro-
| Molecular Formula | C10H5ClFNO |
|---|---|
| Molecular Weight | 209.00 g/mol |
| LogP | 2.69158 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.00436 |
| Heavy Atoms | 14 |
| Complexity | 461.68008 |
Chemical Identifiers
| CAS Number | 175205-57-9 |
|---|---|
| SMILES | C1C(=C(C2=C(O1)C=CC(=C2)F)Cl)C#N |
Product Overview
4-chloro-6-fluoro-2H-chromene-3-carbonitrile (CAS 175205-57-9), with molecular formula C10H5ClFNO and molecular weight 209.00 g/mol. IUPAC: 4-chloro-6-fluoro-2H-chromene-3-carbonitrile.
Chemical Property Profile of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile
Property Insights of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile
The XLogP value of 2.69158 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-6-fluoro-2H-chromene-3-carbonitrile. With a topological polar surface area (TPSA) of 33.02 Ų, 4-chloro-6-fluoro-2H-chromene-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-6-fluoro-2H-chromene-3-carbonitrile 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 4-chloro-6-fluoro-2H-chromene-3-carbonitrile?
The CAS number of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile is 175205-57-9.
What is the molecular formula of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile?
The molecular formula of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile is C10H5ClFNO.
What is the molecular weight of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile?
The molecular weight of 4-chloro-6-fluoro-2H-chromene-3-carbonitrile is 209.00 g/mol.
Where can I buy 4-chloro-6-fluoro-2H-chromene-3-carbonitrile?
You can request a quote for 4-chloro-6-fluoro-2H-chromene-3-carbonitrile 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-chromene-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-6-fluoro-2H-chromene-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.