Azulene, 1,3-diacetyl-
TL;DR: Azulene, 1,3-diacetyl- (CAS 10487-55-5) is a chemical compound with molecular formula C14H12O2 and molecular weight 212.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-acetylazulen-1-yl)ethanone
Also Known As: Azulene, 1,3-diacetyl-, Azulene,1,3-diacetyl-, 1,3-diacetylazulene, 1-(3-acetylazulen-1-yl)ethanone, 1-(3-acetylazulen-1-yl)ethan-1-one
Technical Specifications
| Molecular Formula | C14H12O2 |
| Molecular Weight | 212.08372 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.08372 Da |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
| SMILES | CC(=O)C1=CC(=C2C1=CC=CC=C2)C(=O)C |
| InChIKey | OOMBQAKQCAZTQJ-UHFFFAOYSA-N |
Chemical Property Profile of Azulene, 1,3-diacetyl-
Property Insights of Azulene, 1,3-diacetyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azulene, 1,3-diacetyl-. With a topological polar surface area (TPSA) of 34.1 Ų, Azulene, 1,3-diacetyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azulene, 1,3-diacetyl- 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 Azulene, 1,3-diacetyl-?
The CAS number of Azulene, 1,3-diacetyl- is 10487-55-5.
What is the molecular formula of Azulene, 1,3-diacetyl-?
The molecular formula of Azulene, 1,3-diacetyl- is C14H12O2.
What is the molecular weight of Azulene, 1,3-diacetyl-?
The molecular weight of Azulene, 1,3-diacetyl- is 212.08372 g/mol.
Where can I buy Azulene, 1,3-diacetyl-?
You can request a quote for Azulene, 1,3-diacetyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Azulene, 1,3-diacetyl-?
Yes, CoreyChem provides custom synthesis services for Azulene, 1,3-diacetyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.