4,8-Dimethyl-6-phenylazulene
TL;DR: 4,8-Dimethyl-6-phenylazulene (CAS 42758-88-3) is a chemical compound with molecular formula C18H16 and molecular weight 232.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dimethyl-6-phenylazulene
Also Known As: 4,8-Dimethyl-6-phenylazulene, 4,8-Dimethyl-6-phenylazulene #, Azulene, 4,8-dimethyl-6-phenyl-, J3.317.100E, AO-840/42717930
| Molecular Formula | C18H16 |
|---|---|
| Molecular Weight | 232.13 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.1252 |
| Heavy Atoms | 18 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 42758-88-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C2C1=CC=C2)C)C3=CC=CC=C3 |
| InChIKey | VZINPMRSBOEDPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,8-Dimethyl-6-phenylazulene (CAS 42758-88-3), with molecular formula C18H16 and molecular weight 232.13 g/mol. IUPAC: 4,8-dimethyl-6-phenylazulene.
Chemical Property Profile of 4,8-Dimethyl-6-phenylazulene
Property Insights of 4,8-Dimethyl-6-phenylazulene
The XLogP value of 5.3 indicates that 4,8-Dimethyl-6-phenylazulene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4,8-Dimethyl-6-phenylazulene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,8-Dimethyl-6-phenylazulene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,8-Dimethyl-6-phenylazulene?
The CAS number of 4,8-Dimethyl-6-phenylazulene is 42758-88-3.
What is the molecular formula of 4,8-Dimethyl-6-phenylazulene?
The molecular formula of 4,8-Dimethyl-6-phenylazulene is C18H16.
What is the molecular weight of 4,8-Dimethyl-6-phenylazulene?
The molecular weight of 4,8-Dimethyl-6-phenylazulene is 232.13 g/mol.
Where can I buy 4,8-Dimethyl-6-phenylazulene?
You can request a quote for 4,8-Dimethyl-6-phenylazulene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,8-Dimethyl-6-phenylazulene?
Yes, KEHONG BIO provides custom synthesis services for 4,8-Dimethyl-6-phenylazulene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.