2-(8-nitronaphthalen-1-yl)acetic Acid
TL;DR: 2-(8-nitronaphthalen-1-yl)acetic Acid (CAS 154078-82-7) is a chemical compound with molecular formula C12H9NO4 and molecular weight 231.05316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(8-nitronaphthalen-1-yl)acetic acid
Also Known As: 1-Naphthaleneacetic acid, 8-nitro-, (8-nitro-1-naphthyl)acetic acid, 2-(8-nitronaphthalen-1-yl)acetic Acid
Technical Specifications
| Molecular Formula | C12H9NO4 |
| Molecular Weight | 231.05316 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.05316 Da |
| Heavy Atoms | 17 |
| Complexity | 312.0 |
| SMILES | C1=CC2=C(C(=C1)CC(=O)O)C(=CC=C2)[N+](=O)[O-] |
| InChIKey | ODXGUNIFXIRFNS-UHFFFAOYSA-N |
Chemical Property Profile of 2-(8-nitronaphthalen-1-yl)acetic Acid
Property Insights of 2-(8-nitronaphthalen-1-yl)acetic Acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(8-nitronaphthalen-1-yl)acetic Acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(8-nitronaphthalen-1-yl)acetic Acid. Following Lipinski's Rule of Five, 2-(8-nitronaphthalen-1-yl)acetic Acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(8-nitronaphthalen-1-yl)acetic Acid?
The CAS number of 2-(8-nitronaphthalen-1-yl)acetic Acid is 154078-82-7.
What is the molecular formula of 2-(8-nitronaphthalen-1-yl)acetic Acid?
The molecular formula of 2-(8-nitronaphthalen-1-yl)acetic Acid is C12H9NO4.
What is the molecular weight of 2-(8-nitronaphthalen-1-yl)acetic Acid?
The molecular weight of 2-(8-nitronaphthalen-1-yl)acetic Acid is 231.05316 g/mol.
Where can I buy 2-(8-nitronaphthalen-1-yl)acetic Acid?
You can request a quote for 2-(8-nitronaphthalen-1-yl)acetic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(8-nitronaphthalen-1-yl)acetic Acid?
Yes, CoreyChem provides custom synthesis services for 2-(8-nitronaphthalen-1-yl)acetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.