2-Xanthen-9-ylideneacetonitrile
TL;DR: 2-Xanthen-9-ylideneacetonitrile (CAS 6722-19-6) is a chemical compound with molecular formula C15H9NO and molecular weight 219.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-xanthen-9-ylideneacetonitrile
Also Known As: 2-xanthen-9-ylideneacetonitrile, (9H-Xanthen-9-ylidene)acetonitrile
| Molecular Formula | C15H9NO |
|---|---|
| Molecular Weight | 219.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.06842 |
| Heavy Atoms | 17 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 6722-19-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC#N)C3=CC=CC=C3O2 |
| InChIKey | ZXGYALOAKIHASR-UHFFFAOYSA-N |
Product Overview
2-Xanthen-9-ylideneacetonitrile (CAS 6722-19-6), with molecular formula C15H9NO and molecular weight 219.07 g/mol. IUPAC: 2-xanthen-9-ylideneacetonitrile.
Chemical Property Profile of 2-Xanthen-9-ylideneacetonitrile
Property Insights of 2-Xanthen-9-ylideneacetonitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Xanthen-9-ylideneacetonitrile. With a topological polar surface area (TPSA) of 33.0 Ų, 2-Xanthen-9-ylideneacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Xanthen-9-ylideneacetonitrile 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 2-Xanthen-9-ylideneacetonitrile?
The CAS number of 2-Xanthen-9-ylideneacetonitrile is 6722-19-6.
What is the molecular formula of 2-Xanthen-9-ylideneacetonitrile?
The molecular formula of 2-Xanthen-9-ylideneacetonitrile is C15H9NO.
What is the molecular weight of 2-Xanthen-9-ylideneacetonitrile?
The molecular weight of 2-Xanthen-9-ylideneacetonitrile is 219.07 g/mol.
Where can I buy 2-Xanthen-9-ylideneacetonitrile?
You can request a quote for 2-Xanthen-9-ylideneacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Xanthen-9-ylideneacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Xanthen-9-ylideneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.