Dodecanenitrile
TL;DR: Dodecanenitrile (CAS 2437-25-4) is a chemical compound with molecular formula C12H23N and molecular weight 181.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecanenitrile
Also Known As: Dodecanenitrile, LAURONITRILE, Undecyl cyanide, Dodecanonitrile, n-Undecyl cyanide
| Molecular Formula | C12H23N |
|---|---|
| Molecular Weight | 181.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 181.18304 |
| Heavy Atoms | 13 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 2437-25-4 |
|---|---|
| SMILES | CCCCCCCCCCCC#N |
| InChIKey | VXCUURYYWGCLIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dodecanenitrile (CAS 2437-25-4), with molecular formula C12H23N and molecular weight 181.18 g/mol. IUPAC: dodecanenitrile.
Chemical Property Profile of Dodecanenitrile
Property Insights of Dodecanenitrile
The XLogP value of 4.7 indicates that Dodecanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, Dodecanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecanenitrile 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 Dodecanenitrile?
The CAS number of Dodecanenitrile is 2437-25-4.
What is the molecular formula of Dodecanenitrile?
The molecular formula of Dodecanenitrile is C12H23N.
What is the molecular weight of Dodecanenitrile?
The molecular weight of Dodecanenitrile is 181.18 g/mol.
Where can I buy Dodecanenitrile?
You can request a quote for Dodecanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecanenitrile?
Yes, KEHONG BIO provides custom synthesis services for Dodecanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.