Methyl azulene-1-carboxylate
TL;DR: Methyl azulene-1-carboxylate (CAS 14659-03-1) is a chemical compound with molecular formula C12H10O2 and molecular weight 186.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl azulene-1-carboxylate
Also Known As: methyl azulene-1-carboxylate, methyl azulenecarboxylate, 1-Azulenecarboxylic acid methyl ester, HZDXGIMPRKMFDE-UHFFFAOYSA-, 1-Azulenecarboxylic acid, methyl ester
Technical Specifications
| Molecular Formula | C12H10O2 |
| Molecular Weight | 186.06808 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.06808 Da |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
| SMILES | COC(=O)C1=C2C=CC=CC=C2C=C1 |
| InChIKey | HZDXGIMPRKMFDE-UHFFFAOYSA-N |
Chemical Property Profile of Methyl azulene-1-carboxylate
Property Insights of Methyl azulene-1-carboxylate
The XLogP value of 3.5 indicates that Methyl azulene-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl azulene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl azulene-1-carboxylate 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 Methyl azulene-1-carboxylate?
The CAS number of Methyl azulene-1-carboxylate is 14659-03-1.
What is the molecular formula of Methyl azulene-1-carboxylate?
The molecular formula of Methyl azulene-1-carboxylate is C12H10O2.
What is the molecular weight of Methyl azulene-1-carboxylate?
The molecular weight of Methyl azulene-1-carboxylate is 186.06808 g/mol.
Where can I buy Methyl azulene-1-carboxylate?
You can request a quote for Methyl azulene-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl azulene-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl azulene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.