辛醛
TL;DR: 辛醛 (CAS 124-13-0) is a chemical compound with molecular formula C8H16O and molecular weight 128.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
辛醛
octanal
Also Known As: Octanal, Caprylaldehyde, Caprylic aldehyde, n-Octanal, 1-octanal
| Molecular Formula | C8H16O |
|---|---|
| Molecular Weight | 128.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 128.12012 |
| Heavy Atoms | 9 |
| Complexity | 59.0 |
| Melting Point | -23 °C |
| Boiling Point | 171 °C |
| Density | 0.82 to 0.83 |
| Solubility | In water, 5.6X10+2 mg/L at 25 °C |
| Flash Point | 51.7 °C |
| Vapor Pressure | 1.18 [mmHg] |
| Refractive Index | MAX ABSORPTION (HEXANE): 295 NM (LOG E= 1.11); 1.4217 @ 20 °C |
Chemical Identifiers
| CAS Number | 124-13-0 |
|---|---|
| SMILES | CCCCCCCC=O |
| InChIKey | NUJGJRNETVAIRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
辛醛 (CAS 124-13-0), with molecular formula C8H16O and molecular weight 128.12 g/mol. IUPAC: octanal.
Chemical Property Profile of 辛醛
Property Insights of 辛醛
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 辛醛. With a topological polar surface area (TPSA) of 17.1 Ų, 辛醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 辛醛 has 0 hydrogen bond donor(s) and 1 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 辛醛?
The CAS number of 辛醛 is 124-13-0.
What is the molecular formula of 辛醛?
The molecular formula of 辛醛 is C8H16O.
What is the molecular weight of 辛醛?
The molecular weight of 辛醛 is 128.12 g/mol.
Where can I buy 辛醛?
You can request a quote for 辛醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 辛醛?
Yes, KEHONG BIO provides custom synthesis services for 辛醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.