Isophorone diisocyanate, polymer with adipic acid and diethylene glycol
TL;DR: Isophorone diisocyanate, polymer with adipic acid and diethylene glycol (CAS 55636-50-5) is a chemical compound with molecular formula C22H38N2O9 and molecular weight 474.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexanedioic acid;2-(2-hydroxyethoxy)ethanol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
Also Known As: Isophorone diisocyanate, polymer with adipic acid and diethylene glycol, (C12-H18-N2-O2.C6-H10-O4.C4-H10-O3)x-, Hexanedioic acid, polymer with 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane and 2,2'-oxybis[ethanol], hexanedioic acid;2-(2-hydroxyethoxy)ethanol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, Diethylene glycol, adipic acid, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane copolymer
| Molecular Formula | C22H38N2O9 |
|---|---|
| Molecular Weight | 474.26 g/mol |
| LogP | 1.9466 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 474.25772 |
| Heavy Atoms | 33 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 55636-50-5 |
|---|---|
| SMILES | CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C(CCC(=O)O)CC(=O)O.C(COCCO)O |
| InChIKey | WZOHFFDYFAHGDW-UHFFFAOYSA-N |
Product Overview
Isophorone diisocyanate, polymer with adipic acid and diethylene glycol (CAS 55636-50-5), with molecular formula C22H38N2O9 and molecular weight 474.26 g/mol. IUPAC: hexanedioic acid;2-(2-hydroxyethoxy)ethanol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane.
Chemical Property Profile of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol
Property Insights of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol
The XLogP value of 1.9466 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isophorone diisocyanate, polymer with adipic acid and diethylene glycol. The TPSA of 183.0 Ų indicates high polarity, suggesting Isophorone diisocyanate, polymer with adipic acid and diethylene glycol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isophorone diisocyanate, polymer with adipic acid and diethylene glycol has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol?
The CAS number of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol is 55636-50-5.
What is the molecular formula of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol?
The molecular formula of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol is C22H38N2O9.
What is the molecular weight of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol?
The molecular weight of Isophorone diisocyanate, polymer with adipic acid and diethylene glycol is 474.26 g/mol.
Where can I buy Isophorone diisocyanate, polymer with adipic acid and diethylene glycol?
You can request a quote for Isophorone diisocyanate, polymer with adipic acid and diethylene glycol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isophorone diisocyanate, polymer with adipic acid and diethylene glycol?
Yes, KEHONG BIO provides custom synthesis services for Isophorone diisocyanate, polymer with adipic acid and diethylene glycol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.