壬烷
TL;DR: 壬烷 (CAS 111-84-2) is a chemical compound with molecular formula C9H20 and molecular weight 128.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
壬烷
nonane
Also Known As: NONANE, n-Nonane, Nonyl hydride, Shellsol 140, nonan
| Molecular Formula | C9H20 |
|---|---|
| Molecular Weight | 128.16 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 128.1565 |
| Heavy Atoms | 9 |
| Complexity | 33.0 |
| Melting Point | -51.1 °C |
| Boiling Point | 150.8 °C at 760 mmHg |
| Density | 0.718 at 20.0 °C - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 70 °F (NTP, 1992) |
| Flash Point | 31.1 °C |
| Vapor Pressure | 3.22 mmHg at 20.0 °C ; 10 mmHg at 38.0 °C |
| Refractive Index | 1.4058 at 20 °C |
Chemical Identifiers
| CAS Number | 111-84-2 |
|---|---|
| SMILES | CCCCCCCCC |
| InChIKey | BKIMMITUMNQMOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
壬烷 (CAS 111-84-2), with molecular formula C9H20 and molecular weight 128.16 g/mol. IUPAC: nonane.
Chemical Property Profile of 壬烷
Property Insights of 壬烷
The XLogP value of 4.5 indicates that 壬烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 壬烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 壬烷 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 壬烷?
The CAS number of 壬烷 is 111-84-2.
What is the molecular formula of 壬烷?
The molecular formula of 壬烷 is C9H20.
What is the molecular weight of 壬烷?
The molecular weight of 壬烷 is 128.16 g/mol.
Where can I buy 壬烷?
You can request a quote for 壬烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 壬烷?
Yes, KEHONG BIO provides custom synthesis services for 壬烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.