9-十八碳烯腈
TL;DR: 9-十八碳烯腈 (CAS 112-91-4) is a chemical compound with molecular formula C18H33N and molecular weight 263.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-十八碳烯腈
octadec-9-enenitrile
Also Known As: 9-Octadecenenitrile, Oelsaeurenitril, Oleonitrile, 9-Octadecenenitrile, (9Z)-, OCTADEC-9-ENENITRILE
| Molecular Formula | C18H33N |
|---|---|
| Molecular Weight | 263.26 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Exact Mass | 263.2613 |
| Heavy Atoms | 19 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 112-91-4 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC#N |
| InChIKey | UIAMCVSNZQYIQS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-十八碳烯腈 (CAS 112-91-4), with molecular formula C18H33N and molecular weight 263.26 g/mol. IUPAC: octadec-9-enenitrile.
Chemical Property Profile of 9-十八碳烯腈
Property Insights of 9-十八碳烯腈
The XLogP value of 7.1 indicates that 9-十八碳烯腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 9-十八碳烯腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-十八碳烯腈 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-十八碳烯腈?
The CAS number of 9-十八碳烯腈 is 112-91-4.
What is the molecular formula of 9-十八碳烯腈?
The molecular formula of 9-十八碳烯腈 is C18H33N.
What is the molecular weight of 9-十八碳烯腈?
The molecular weight of 9-十八碳烯腈 is 263.26 g/mol.
Where can I buy 9-十八碳烯腈?
You can request a quote for 9-十八碳烯腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-十八碳烯腈?
Yes, KEHONG BIO provides custom synthesis services for 9-十八碳烯腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.