3,7-Dimethyl-2-methylene-6-octenal, (+-)-
TL;DR: 3,7-Dimethyl-2-methylene-6-octenal, (+-)- (CAS 22418-66-2) is a chemical compound with molecular formula C11H18O and molecular weight 166.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethyl-2-methylideneoct-6-enal
Also Known As: alpha-Methylenecitronellal, 3,7-Dimethyl-2-methyleneocta-6-enal, 3,7-dimethyl-2-methylideneoct-6-enal, 3,7-dimethyl-2-methylene-6-octenal, 6-Octenal, 3,7-dimethyl-2-methylene-
| Molecular Formula | C11H18O |
|---|---|
| Molecular Weight | 166.14 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 166.13577 |
| Heavy Atoms | 12 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 22418-66-2 |
|---|---|
| SMILES | CC(CCC=C(C)C)C(=C)C=O |
| InChIKey | FAGYGFPZNTYLAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,7-Dimethyl-2-methylene-6-octenal, (+-)- (CAS 22418-66-2), with molecular formula C11H18O and molecular weight 166.14 g/mol. IUPAC: 3,7-dimethyl-2-methylideneoct-6-enal.
Chemical Property Profile of 3,7-Dimethyl-2-methylene-6-octenal, (+-)-
Property Insights of 3,7-Dimethyl-2-methylene-6-octenal, (+-)-
The XLogP value of 3.4 indicates that 3,7-Dimethyl-2-methylene-6-octenal, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3,7-Dimethyl-2-methylene-6-octenal, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dimethyl-2-methylene-6-octenal, (+-)- 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 3,7-Dimethyl-2-methylene-6-octenal, (+-)-?
The CAS number of 3,7-Dimethyl-2-methylene-6-octenal, (+-)- is 22418-66-2.
What is the molecular formula of 3,7-Dimethyl-2-methylene-6-octenal, (+-)-?
The molecular formula of 3,7-Dimethyl-2-methylene-6-octenal, (+-)- is C11H18O.
What is the molecular weight of 3,7-Dimethyl-2-methylene-6-octenal, (+-)-?
The molecular weight of 3,7-Dimethyl-2-methylene-6-octenal, (+-)- is 166.14 g/mol.
Where can I buy 3,7-Dimethyl-2-methylene-6-octenal, (+-)-?
You can request a quote for 3,7-Dimethyl-2-methylene-6-octenal, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dimethyl-2-methylene-6-octenal, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dimethyl-2-methylene-6-octenal, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.