Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol
TL;DR: Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol (CAS 9063-78-9) is a chemical compound with molecular formula C20H30N2O10 and molecular weight 458.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diisocyanato-2-methylbenzene;ethane-1,2-diol;hexanedioic acid;propane-1,2-diol
Also Known As: Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol, Adipic acid, ethylene glycol, propylene glycol, toluene diisocyanate polymer, Ethylene glycol, propylene glycol, adipic acid, toluene diisocyanate polymer, (C9-H6-N2-O2.C6-H10-O4.C3-H8-O2.C2-H6-O2)x-, Hexanedioic acid, 1,2-ethanediol, 1,2-propanediol, 1,3-diisocyanatomethylbenzene polymer
| Molecular Formula | C20H30N2O10 |
|---|---|
| Molecular Weight | 458.19 g/mol |
| LogP | 0.97612 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 458.19003 |
| Heavy Atoms | 32 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 9063-78-9 |
|---|---|
| SMILES | CC1=C(C=CC=C1N=C=O)N=C=O.CC(CO)O.C(CCC(=O)O)CC(=O)O.C(CO)O |
| InChIKey | GDQXHZIBOWESRU-UHFFFAOYSA-N |
Product Overview
Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol (CAS 9063-78-9), with molecular formula C20H30N2O10 and molecular weight 458.19 g/mol. IUPAC: 1,3-diisocyanato-2-methylbenzene;ethane-1,2-diol;hexanedioic acid;propane-1,2-diol.
Chemical Property Profile of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol
Property Insights of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol
The XLogP value of 0.97612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol. The TPSA of 214.0 Ų indicates high polarity, suggesting Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol?
The CAS number of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol is 9063-78-9.
What is the molecular formula of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol?
The molecular formula of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol is C20H30N2O10.
What is the molecular weight of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol?
The molecular weight of Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol is 458.19 g/mol.
Where can I buy Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol?
You can request a quote for Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for Hexanedioic acid, polymer with 1,3-diisocyanatomethylbenzene, 1,2-ethanediol and 1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.