2-甲基戊烷
TL;DR: 2-甲基戊烷 (CAS 107-83-5) is a chemical compound with molecular formula C6H14 and molecular weight 86.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲基戊烷
2-methylpentane
Also Known As: 2-METHYLPENTANE, Isohexane, Pentane, 2-methyl-, Hexanes, 2-Methylpentan
| Molecular Formula | C6H14 |
|---|---|
| Molecular Weight | 86.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 86.10955 |
| Heavy Atoms | 6 |
| Complexity | 21.0 |
| Melting Point | -153.7 °C |
| Boiling Point | 60.3 °C at 760 mmHg |
| Density | 0.653 at 20.0 °C - Less dense than water; will float |
| Solubility | In water, 14 mg/L |
| Flash Point | -28.9 °C |
| Vapor Pressure | 310.2 mmHg |
| Refractive Index | 1.3715 at 20 °C |
| GHS Signal | Danger |
| H-Statements | H225, H304, H315, H336, H361f, H372, H411 |
Chemical Identifiers
| CAS Number | 107-83-5 |
|---|---|
| SMILES | CCCC(C)C |
| InChIKey | AFABGHUZZDYHJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-甲基戊烷 (CAS 107-83-5), with molecular formula C6H14 and molecular weight 86.11 g/mol. IUPAC: 2-methylpentane.
Chemical Property Profile of 2-甲基戊烷
Property Insights of 2-甲基戊烷
The XLogP value of 3.2 indicates that 2-甲基戊烷 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-甲基戊烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-甲基戊烷 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-甲基戊烷?
The CAS number of 2-甲基戊烷 is 107-83-5.
What is the molecular formula of 2-甲基戊烷?
The molecular formula of 2-甲基戊烷 is C6H14.
What is the molecular weight of 2-甲基戊烷?
The molecular weight of 2-甲基戊烷 is 86.11 g/mol.
Where can I buy 2-甲基戊烷?
You can request a quote for 2-甲基戊烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲基戊烷?
Yes, KEHONG BIO provides custom synthesis services for 2-甲基戊烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.