2,4,6-Triisopropyl-m-phenylene diisocyanate
TL;DR: 2,4,6-Triisopropyl-m-phenylene diisocyanate (CAS 2162-73-4) is a chemical compound with molecular formula C17H22N2O2 and molecular weight 286.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diisocyanato-1,3,5-tri(propan-2-yl)benzene
Also Known As: 2,4,6-Triisopropyl-m-phenylene diisocyanate, 2,4-diisocyanato-1,3,5-tri(propan-2-yl)benzene, 2,4,6-triisopropyl-m-phenylenediisocyanate, 2,4-diisocyanato-1,3,5-triisopropylbenzene, 2,4-diisocyanato-1,3,5-tris(propan-2-yl)benzene
| Molecular Formula | C17H22N2O2 |
|---|---|
| Molecular Weight | 286.17 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.16812 |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 2162-73-4 |
|---|---|
| SMILES | CC(C)C1=CC(=C(C(=C1N=C=O)C(C)C)N=C=O)C(C)C |
| InChIKey | AZAKSPACDDRBQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Triisopropyl-m-phenylene diisocyanate (CAS 2162-73-4), with molecular formula C17H22N2O2 and molecular weight 286.17 g/mol. IUPAC: 2,4-diisocyanato-1,3,5-tri(propan-2-yl)benzene.
Chemical Property Profile of 2,4,6-Triisopropyl-m-phenylene diisocyanate
Property Insights of 2,4,6-Triisopropyl-m-phenylene diisocyanate
The XLogP value of 6.9 indicates that 2,4,6-Triisopropyl-m-phenylene diisocyanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 2,4,6-Triisopropyl-m-phenylene diisocyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Triisopropyl-m-phenylene diisocyanate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,6-Triisopropyl-m-phenylene diisocyanate?
The CAS number of 2,4,6-Triisopropyl-m-phenylene diisocyanate is 2162-73-4.
What is the molecular formula of 2,4,6-Triisopropyl-m-phenylene diisocyanate?
The molecular formula of 2,4,6-Triisopropyl-m-phenylene diisocyanate is C17H22N2O2.
What is the molecular weight of 2,4,6-Triisopropyl-m-phenylene diisocyanate?
The molecular weight of 2,4,6-Triisopropyl-m-phenylene diisocyanate is 286.17 g/mol.
Where can I buy 2,4,6-Triisopropyl-m-phenylene diisocyanate?
You can request a quote for 2,4,6-Triisopropyl-m-phenylene diisocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Triisopropyl-m-phenylene diisocyanate?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Triisopropyl-m-phenylene diisocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.