NY 008
TL;DR: NY 008 (CAS 15991-93-2) is a chemical compound with molecular formula C16H22O2 and molecular weight 246.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-octyl-3H-2-benzofuran-1-one
Also Known As: 3-Octylphthalide, octylphthalide, Octylphtalide, 3-octyl-3H-2-benzofuran-1-one, NY 008
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H22O2 |
| Molecular Weight | 246.16199 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 246.16199 Da |
| Heavy Atoms | 18 |
| Complexity | 262.0 |
| SMILES | CCCCCCCCC1C2=CC=CC=C2C(=O)O1 |
| InChIKey | MYGRPRSFUHJZPY-UHFFFAOYSA-N |
Chemical Property Profile of NY 008
Property Insights of NY 008
The XLogP value of 5.0 indicates that NY 008 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, NY 008 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NY 008 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
What is the CAS number of NY 008?
The CAS number of NY 008 is 15991-93-2.
What is the molecular formula of NY 008?
The molecular formula of NY 008 is C16H22O2.
What is the molecular weight of NY 008?
The molecular weight of NY 008 is 246.16199 g/mol.
Where can I buy NY 008?
You can request a quote for NY 008 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for NY 008?
Yes, CoreyChem provides custom synthesis services for NY 008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.