Methylheptenene
TL;DR: Methylheptenene (CAS 136434-77-0) is a chemical compound with molecular formula C8H14 and molecular weight 110.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octa-2,4-diene
Also Known As: methylheptenene, octa-2,4-diene, 2,4-Octadiene, (2E,4E)-octa-2,4-diene, 1-Bromo-2-fluoro-4-iodobenzene
| Molecular Formula | C8H14 |
|---|---|
| Molecular Weight | 110.11 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 110.10955 |
| Heavy Atoms | 8 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 136434-77-0 |
|---|---|
| SMILES | CCCC=CC=CC |
| InChIKey | NZLCAHVLJPDRBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methylheptenene (CAS 136434-77-0), with molecular formula C8H14 and molecular weight 110.11 g/mol. IUPAC: octa-2,4-diene.
Chemical Property Profile of Methylheptenene
Property Insights of Methylheptenene
The XLogP value of 3.3 indicates that Methylheptenene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Methylheptenene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methylheptenene 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 Methylheptenene?
The CAS number of Methylheptenene is 136434-77-0.
What is the molecular formula of Methylheptenene?
The molecular formula of Methylheptenene is C8H14.
What is the molecular weight of Methylheptenene?
The molecular weight of Methylheptenene is 110.11 g/mol.
Where can I buy Methylheptenene?
You can request a quote for Methylheptenene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylheptenene?
Yes, KEHONG BIO provides custom synthesis services for Methylheptenene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.