4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid
TL;DR: 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid (CAS 108011-98-9) is a chemical compound with molecular formula C15H12O3 and molecular weight 240.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-4-(6-methylnaphthalen-2-yl)-4-oxobut-2-enoic acid
Also Known As: 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid, Cid 6443879, 4-(6-Methylnaphthalen-2-yl)-4-oxo-2-butenoic acid, 4-(6-methylnaphthalen-2-yl)-4-oxobut-2-enoic acid, (E)-4-(6-methylnaphthalen-2-yl)-4-oxobut-2-enoic acid
Technical Specifications
| Molecular Formula | C15H12O3 |
| Molecular Weight | 240.07864 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.07864 Da |
| Heavy Atoms | 18 |
| Complexity | 359.0 |
| SMILES | CC1=CC2=C(C=C1)C=C(C=C2)C(=O)/C=C/C(=O)O |
| InChIKey | HEMRODJABLVZTQ-VOTSOKGWSA-N |
Chemical Property Profile of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid
Property Insights of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid
The XLogP value of 3.0 indicates that 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid?
The CAS number of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid is 108011-98-9.
What is the molecular formula of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid?
The molecular formula of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid is C15H12O3.
What is the molecular weight of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid?
The molecular weight of 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid is 240.07864 g/mol.
Where can I buy 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid?
You can request a quote for 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid?
Yes, CoreyChem provides custom synthesis services for 4-(6-Methylnapthalen-2-yl)-4-oxobut-2-enoc acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.