(C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-
TL;DR: (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- (CAS 67892-80-2) is a chemical compound with molecular formula C25H46O11 and molecular weight 522.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexane-1,6-diol
Also Known As: (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-, 1,3-Benzenedicarboxylic acid, trimethylolpropane, neopentyl glycol,1,6-hexanediol polymer, 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol and 1,6-hexanediol, 1,3-Benzenedicarboxylic acid, trimethylolpropane, neopentyl glycol, 1,6-hexanediol polymer, benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol
| Molecular Formula | C25H46O11 |
|---|---|
| Molecular Weight | 522.30 g/mol |
| LogP | 0.9713 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 522.304 |
| Heavy Atoms | 36 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 67892-80-2 |
|---|---|
| SMILES | CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO |
| InChIKey | UYGZYRAORIEMME-UHFFFAOYSA-N |
Product Overview
(C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- (CAS 67892-80-2), with molecular formula C25H46O11 and molecular weight 522.30 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexane-1,6-diol.
Chemical Property Profile of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-
Property Insights of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-
The XLogP value of 0.9713 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-. The TPSA of 216.0 Ų indicates high polarity, suggesting (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- has 9 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 (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-?
The CAS number of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- is 67892-80-2.
What is the molecular formula of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-?
The molecular formula of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- is C25H46O11.
What is the molecular weight of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-?
The molecular weight of (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- is 522.30 g/mol.
Where can I buy (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-?
You can request a quote for (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-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-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C8-H6-O4.C6-H14-O3.C6-H14-O2.C5-H12-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.