Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]
TL;DR: Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] (CAS 67815-75-2) is a chemical compound with molecular formula C30H38N4O13 and molecular weight 662.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diisocyanato-2-methylbenzene;2,4-diisocyanato-1-methylbenzene;ethane-1,2-diol;hexanedioic acid;2-(2-hydroxyethoxy)ethanol
Also Known As: Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol], (C9-H6-N2-O2.C9-H6-N2-O2.C6-H10-O4.C4-H10-O3.C2-H6-O2)x-, 1,3-diisocyanato-2-methylbenzene; 2,4-diisocyanato-1-methylbenzene; ethane-1,2-diol; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol, Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis(ethanol), Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene,2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]
| Molecular Formula | C30H38N4O13 |
|---|---|
| Molecular Weight | 662.24 g/mol |
| LogP | 2.53384 |
| Topological Polar Surface Area | 282.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 14 |
| Exact Mass | 662.2435 |
| Heavy Atoms | 47 |
| Complexity | 649.0 |
Chemical Identifiers
| CAS Number | 67815-75-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N=C=O)N=C=O.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O.C(COCCO)O |
| InChIKey | QRBUDVXJCOSUPE-UHFFFAOYSA-N |
Product Overview
Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] (CAS 67815-75-2), with molecular formula C30H38N4O13 and molecular weight 662.24 g/mol. IUPAC: 1,3-diisocyanato-2-methylbenzene;2,4-diisocyanato-1-methylbenzene;ethane-1,2-diol;hexanedioic acid;2-(2-hydroxyethoxy)ethanol.
Chemical Property Profile of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]
Property Insights of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]
The XLogP value of 2.53384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]. The TPSA of 282.0 Ų indicates high polarity, suggesting Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] has 6 hydrogen bond donor(s) and 17 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-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]?
The CAS number of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] is 67815-75-2.
What is the molecular formula of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]?
The molecular formula of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] is C30H38N4O13.
What is the molecular weight of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]?
The molecular weight of Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] is 662.24 g/mol.
Where can I buy Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]?
You can request a quote for Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] 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-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol]?
Yes, KEHONG BIO provides custom synthesis services for Hexanedioic acid, polymer with 1,3-diisocyanato-2-methylbenzene, 2,4-diisocyanato-1-methylbenzene, 1,2-ethanediol and 2,2'-oxybis[ethanol] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.