2-Methylpentane
TL;DR: 2-Methylpentane (CAS 107-83-5) is a chemical compound with molecular formula C6H14 and molecular weight 86.10955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methylpentane
Also Known As: 2-METHYLPENTANE, Isohexane, Pentane, 2-methyl-, Hexanes, 2-Methylpentan
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H14 |
| Molecular Weight | 86.10955 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 86.10955 Da |
| Heavy Atoms | 6 |
| Complexity | 21.0 |
| Purity | ≥98.5% |
| Melting Point | -244.6 °F (USCG, 1999) |
| Boiling Point | 140.5 °F at 760 mmHg (USCG, 1999) |
| Density | 0.653 at 68 °F (USCG, 1999) - Less dense than water; will float |
| Flash Point | -20 °F (USCG, 1999) |
| Vapor Pressure | 310.2 mmHg (USCG, 1999) |
| Refractive Index | Index of refraction: 1.3715 at 20 °C/D |
| Solubility | In water, 14 mg/L |
| SMILES | CCCC(C)C |
| InChIKey | AFABGHUZZDYHJO-UHFFFAOYSA-N |
Safety Information
H225, H304, H315, H336, H361f, H372, H411
Chemical Property Profile of 2-Methylpentane
Property Insights of 2-Methylpentane
The XLogP value of 3.2 indicates that 2-Methylpentane 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-Methylpentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpentane 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
What is the CAS number of 2-Methylpentane?
The CAS number of 2-Methylpentane is 107-83-5.
What is the molecular formula of 2-Methylpentane?
The molecular formula of 2-Methylpentane is C6H14.
What is the molecular weight of 2-Methylpentane?
The molecular weight of 2-Methylpentane is 86.10955 g/mol.
Where can I buy 2-Methylpentane?
You can request a quote for 2-Methylpentane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methylpentane?
Yes, CoreyChem provides custom synthesis services for 2-Methylpentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.