3-Methyleneheptane
TL;DR: 3-Methyleneheptane (CAS 1632-16-2) is a chemical compound with molecular formula C8H16 and molecular weight 112.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylideneheptane
Also Known As: 2-ETHYL-1-HEXENE, 3-methyleneheptane, Heptane, 3-methylene-, 2-Ethylhexene, 3-methylideneheptane
| Molecular Formula | C8H16 |
|---|---|
| Molecular Weight | 112.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 112.1252 |
| Heavy Atoms | 8 |
| Complexity | 62.0 |
| Vapor Pressure | 19.7 [mmHg] |
Chemical Identifiers
| CAS Number | 1632-16-2 |
|---|---|
| SMILES | CCCCC(=C)CC |
| InChIKey | XTVRLCUJHGUXCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyleneheptane (CAS 1632-16-2), with molecular formula C8H16 and molecular weight 112.13 g/mol. IUPAC: 3-methylideneheptane.
Chemical Property Profile of 3-Methyleneheptane
Property Insights of 3-Methyleneheptane
The XLogP value of 4.0 indicates that 3-Methyleneheptane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methyleneheptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyleneheptane 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 3-Methyleneheptane?
The CAS number of 3-Methyleneheptane is 1632-16-2.
What is the molecular formula of 3-Methyleneheptane?
The molecular formula of 3-Methyleneheptane is C8H16.
What is the molecular weight of 3-Methyleneheptane?
The molecular weight of 3-Methyleneheptane is 112.13 g/mol.
Where can I buy 3-Methyleneheptane?
You can request a quote for 3-Methyleneheptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyleneheptane?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyleneheptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.