Chamomile octenone
TL;DR: Chamomile octenone (CAS 68419-46-5) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-dimethyloct-5-en-4-one
Also Known As: chamomile octenone, 2,7-Dimethyloct-5-en-4-one, 5-Octen-4-one, 2,7-dimethyl-, 2,7-Dimethyl-5-octen-4-one, 2,7-Dimethyl-oct-5-en-4-one
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 68419-46-5 |
|---|---|
| SMILES | CC(C)CC(=O)C=CC(C)C |
| InChIKey | CZOUKEVZSCNCAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chamomile octenone (CAS 68419-46-5), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 2,7-dimethyloct-5-en-4-one.
Chemical Property Profile of Chamomile octenone
Property Insights of Chamomile octenone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chamomile octenone. With a topological polar surface area (TPSA) of 17.1 Ų, Chamomile octenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chamomile octenone has 0 hydrogen bond donor(s) and 1 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 Chamomile octenone?
The CAS number of Chamomile octenone is 68419-46-5.
What is the molecular formula of Chamomile octenone?
The molecular formula of Chamomile octenone is C10H18O.
What is the molecular weight of Chamomile octenone?
The molecular weight of Chamomile octenone is 154.14 g/mol.
Where can I buy Chamomile octenone?
You can request a quote for Chamomile octenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chamomile octenone?
Yes, KEHONG BIO provides custom synthesis services for Chamomile octenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.