2-Methyl-1,7-octadiene
TL;DR: 2-Methyl-1,7-octadiene (CAS 13151-07-0) 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-methylocta-1,7-diene
Also Known As: 2-methyl-1,7-octadiene, 2-methylocta-1,7-diene, 1,7-Octadiene, 2-methyl, 1,7-Octadiene, 2-methyl-, RefChem:262909
| Molecular Formula | C9H16 |
|---|---|
| Molecular Weight | 124.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 124.1252 |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 13151-07-0 |
|---|---|
| SMILES | CC(=C)CCCCC=C |
| InChIKey | GRMXFZGBPICEAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1,7-octadiene (CAS 13151-07-0), with molecular formula C9H16 and molecular weight 124.13 g/mol. IUPAC: 2-methylocta-1,7-diene.
Chemical Property Profile of 2-Methyl-1,7-octadiene
Property Insights of 2-Methyl-1,7-octadiene
The XLogP value of 4.1 indicates that 2-Methyl-1,7-octadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Methyl-1,7-octadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1,7-octadiene 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 2-Methyl-1,7-octadiene?
The CAS number of 2-Methyl-1,7-octadiene is 13151-07-0.
What is the molecular formula of 2-Methyl-1,7-octadiene?
The molecular formula of 2-Methyl-1,7-octadiene is C9H16.
What is the molecular weight of 2-Methyl-1,7-octadiene?
The molecular weight of 2-Methyl-1,7-octadiene is 124.13 g/mol.
Where can I buy 2-Methyl-1,7-octadiene?
You can request a quote for 2-Methyl-1,7-octadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1,7-octadiene?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1,7-octadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.