(C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-
TL;DR: (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- (CAS 52453-94-8) is a chemical compound with molecular formula C20H26O10 and molecular weight 426.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzofuran-1,3-dione;2,2-dimethylpropane-1,3-diol;furan-2,5-dione;propane-1,2-diol
Also Known As: (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-, Propylene glycol, neopentyl glycol, maleic anhydride, phthalic anhydride polymer, 1,3-Isobenzofurandione, polymer with 2,2-dimethyl-1,3-propanediol, 2,5-furandione and 1,2-propanediol, 2-benzofuran-1,3-dione; 2,2-dimethylpropane-1,3-diol; furan-2,5-dione; propane-1,2-diol, Maleic anhydride, phthalic anhydride, propylene glycol, neopentyl glycol polymer
| Molecular Formula | C20H26O10 |
|---|---|
| Molecular Weight | 426.15 g/mol |
| LogP | -0.0201 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.1526 |
| Heavy Atoms | 30 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 52453-94-8 |
|---|---|
| SMILES | CC(CO)O.CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O |
| InChIKey | OQQIRLYFKHQUKT-UHFFFAOYSA-N |
Product Overview
(C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- (CAS 52453-94-8), with molecular formula C20H26O10 and molecular weight 426.15 g/mol. IUPAC: 2-benzofuran-1,3-dione;2,2-dimethylpropane-1,3-diol;furan-2,5-dione;propane-1,2-diol.
Chemical Property Profile of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-
Property Insights of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-
The XLogP value of -0.0201 indicates that (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-?
The CAS number of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- is 52453-94-8.
What is the molecular formula of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-?
The molecular formula of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- is C20H26O10.
What is the molecular weight of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-?
The molecular weight of (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- is 426.15 g/mol.
Where can I buy (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-?
You can request a quote for (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)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.C5-H12-O2.C4-H2-O3.C3-H8-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C8-H4-O3.C5-H12-O2.C4-H2-O3.C3-H8-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.