(C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-
TL;DR: (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- (CAS 42767-90-8) is a chemical compound with molecular formula C22H28O14 and molecular weight 516.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzofuran-1,3-dione;(E)-but-2-enedioic acid;hexanedioic acid;2-(2-hydroxyethoxy)ethanol
Also Known As: (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-, But-2-enedioic Acid; Hexanedioic Acid; 2-(2-hydroxyethoxy)ethanol; Isobenzofuran-1,3-dione, 2-benzofuran-1,3-dione; (E)-but-2-enedioic acid; hexanedioic acid; 2-(2-hydroxyethoxy)ethanol, Hexanedioic acid, polymer with (2E)-2-butenedioic acid, 1,3-isobenzofurandione and 2,2'-oxybis(ethanol), Hexanedioic acid, polymer with (2E)-2-butenedioic acid, 1,3-isobenzofurandione and 2,2'-oxybis[ethanol]
| Molecular Formula | C22H28O14 |
|---|---|
| Molecular Weight | 516.15 g/mol |
| LogP | 0.4126 |
| Topological Polar Surface Area | 242.26 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 516.1479 |
| Heavy Atoms | 36 |
| Complexity | 821.48627 |
Chemical Identifiers
| CAS Number | 42767-90-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
(C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- (CAS 42767-90-8), with molecular formula C22H28O14 and molecular weight 516.15 g/mol. IUPAC: 2-benzofuran-1,3-dione;(E)-but-2-enedioic acid;hexanedioic acid;2-(2-hydroxyethoxy)ethanol.
Chemical Property Profile of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-
Property Insights of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-
The XLogP value of 0.4126 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-. The TPSA of 242.26 Ų indicates high polarity, suggesting (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-?
The CAS number of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- is 42767-90-8.
What is the molecular formula of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-?
The molecular formula of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- is C22H28O14.
What is the molecular weight of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-?
The molecular weight of (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- is 516.15 g/mol.
Where can I buy (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-?
You can request a quote for (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x-?
Yes, KEHONG BIO provides custom synthesis services for (C8-H4-O3.C6-H10-O4.C4-H10-O3.C4-H4-O4)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.