Undecane, 1,6,11-triisocyanato-
TL;DR: Undecane, 1,6,11-triisocyanato- (CAS 70198-24-2) is a chemical compound with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,6,11-triisocyanatoundecane
Also Known As: 1,6,11-Triisocyanatoundecane, Undecane, 1,6,11-triisocyanato-, Undecane-1,6,11-triyl triisocyanate, 1,6,11-Undecanetriyltriisocyanate, EINECS 274-379-8
| Molecular Formula | C14H21N3O3 |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 279.1583 |
| Heavy Atoms | 20 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 70198-24-2 |
|---|---|
| SMILES | C(CCC(CCCCCN=C=O)N=C=O)CCN=C=O |
| InChIKey | VAGFVLBAZGSOAC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Undecane, 1,6,11-triisocyanato- (CAS 70198-24-2), with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol. IUPAC: 1,6,11-triisocyanatoundecane.
Chemical Property Profile of Undecane, 1,6,11-triisocyanato-
Property Insights of Undecane, 1,6,11-triisocyanato-
The XLogP value of 5.4 indicates that Undecane, 1,6,11-triisocyanato- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Undecane, 1,6,11-triisocyanato-. Following Lipinski's Rule of Five, Undecane, 1,6,11-triisocyanato- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Undecane, 1,6,11-triisocyanato-?
The CAS number of Undecane, 1,6,11-triisocyanato- is 70198-24-2.
What is the molecular formula of Undecane, 1,6,11-triisocyanato-?
The molecular formula of Undecane, 1,6,11-triisocyanato- is C14H21N3O3.
What is the molecular weight of Undecane, 1,6,11-triisocyanato-?
The molecular weight of Undecane, 1,6,11-triisocyanato- is 279.16 g/mol.
Where can I buy Undecane, 1,6,11-triisocyanato-?
You can request a quote for Undecane, 1,6,11-triisocyanato- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undecane, 1,6,11-triisocyanato-?
Yes, KEHONG BIO provides custom synthesis services for Undecane, 1,6,11-triisocyanato- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.