Geraniolene
TL;DR: Geraniolene (CAS 6709-39-3) is a chemical compound with molecular formula C9H16 and molecular weight 124.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethylhepta-1,5-diene
Also Known As: Geraniolene, 2,6-Dimethylhepta-1,5-diene, 1,5-Heptadiene, 2,6-dimethyl-, 2,6-Dimethyl-1,5-heptadiene, 2,6-Dimethyl-1,5-heptadiene #
| Molecular Formula | C9H16 |
|---|---|
| Molecular Weight | 124.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 124.1252 |
| Heavy Atoms | 9 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 6709-39-3 |
|---|---|
| SMILES | CC(=CCCC(=C)C)C |
| InChIKey | DONSTYDPUORSDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Geraniolene (CAS 6709-39-3), with molecular formula C9H16 and molecular weight 124.13 g/mol. IUPAC: 2,6-dimethylhepta-1,5-diene.
Chemical Property Profile of Geraniolene
Property Insights of Geraniolene
The XLogP value of 3.9 indicates that Geraniolene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Geraniolene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Geraniolene 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 Geraniolene?
The CAS number of Geraniolene is 6709-39-3.
What is the molecular formula of Geraniolene?
The molecular formula of Geraniolene is C9H16.
What is the molecular weight of Geraniolene?
The molecular weight of Geraniolene is 124.13 g/mol.
Where can I buy Geraniolene?
You can request a quote for Geraniolene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Geraniolene?
Yes, KEHONG BIO provides custom synthesis services for Geraniolene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.