Nonanenitrile
TL;DR: Nonanenitrile (CAS 2243-27-8) is a chemical compound with molecular formula C9H17N and molecular weight 139.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonanenitrile
Also Known As: Nonanenitrile, n-Octyl cyanide, Octyl cyanide, n-Octylcyanide, Pelargonitrile
| Molecular Formula | C9H17N |
|---|---|
| Molecular Weight | 139.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 139.1361 |
| Heavy Atoms | 10 |
| Complexity | 98.0 |
| Melting Point | -34.2 °C |
| Boiling Point | 224.4 °C @760 [mm Hg] |
| Density | 0.8178 @ 20°C |
| Vapor Pressure | 0.1 [mmHg] |
Chemical Identifiers
| CAS Number | 2243-27-8 |
|---|---|
| SMILES | CCCCCCCCC#N |
| InChIKey | PLZZPPHAMDJOSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nonanenitrile (CAS 2243-27-8), with molecular formula C9H17N and molecular weight 139.14 g/mol. IUPAC: nonanenitrile.
Chemical Property Profile of Nonanenitrile
Property Insights of Nonanenitrile
The XLogP value of 3.1 indicates that Nonanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, Nonanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonanenitrile 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 Nonanenitrile?
The CAS number of Nonanenitrile is 2243-27-8.
What is the molecular formula of Nonanenitrile?
The molecular formula of Nonanenitrile is C9H17N.
What is the molecular weight of Nonanenitrile?
The molecular weight of Nonanenitrile is 139.14 g/mol.
Where can I buy Nonanenitrile?
You can request a quote for Nonanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonanenitrile?
Yes, KEHONG BIO provides custom synthesis services for Nonanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.