香油薁
TL;DR: 香油薁 (CAS 529-05-5) is a chemical compound with molecular formula C14H16 and molecular weight 184.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
香油薁
7-ethyl-1,4-dimethylazulene
Also Known As: Chamazulene, Chamazulen, Dimethulene, Camazulene, Dimethulen
| Molecular Formula | C14H16 |
|---|---|
| Molecular Weight | 184.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.1252 |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
| Melting Point | < 25 °C |
| Boiling Point | 159.00 °C. @ 11.00 mm Hg |
Chemical Identifiers
| CAS Number | 529-05-5 |
|---|---|
| SMILES | CCC1=CC2=C(C=CC2=C(C=C1)C)C |
| InChIKey | GXGJIOMUZAGVEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
香油薁 (CAS 529-05-5), with molecular formula C14H16 and molecular weight 184.13 g/mol. IUPAC: 7-ethyl-1,4-dimethylazulene.
Chemical Property Profile of 香油薁
Property Insights of 香油薁
The XLogP value of 4.4 indicates that 香油薁 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 香油薁 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 香油薁 has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 香油薁?
The CAS number of 香油薁 is 529-05-5.
What is the molecular formula of 香油薁?
The molecular formula of 香油薁 is C14H16.
What is the molecular weight of 香油薁?
The molecular weight of 香油薁 is 184.13 g/mol.
Where can I buy 香油薁?
You can request a quote for 香油薁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 香油薁?
Yes, KEHONG BIO provides custom synthesis services for 香油薁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.