(C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-
TL;DR: (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- (CAS 69847-42-3) is a chemical compound with molecular formula C29H48O13 and molecular weight 604.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;dimethyl cyclohexane-1,4-dicarboxylate;2,2-dimethylpropane-1,3-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol
Also Known As: (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-, 1,3-Benzenedicarboxylic acid, polymer with dimethyl 1,4-cyclohexanedicarboxylate, 2,2-dimethyl-1,3-propanediol and 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, benzene-1,3-dicarboxylic acid; dimethyl cyclohexane-1,4-dicarboxylate; 2,2-dimethylpropane-1,3-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol, 1,3-Benzenedicarboxylic acid, polymer with 1,4-dimethyl 1,4-cyclohexanedicarboxylate, 2,2-dimethyl-1,3-propanediol and 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, Dimethyl 1,4-cyclohexanedicarboxylate, isophthalic acid, neopentyl glycol, trimethylolpropane polymer
| Molecular Formula | C29H48O13 |
|---|---|
| Molecular Weight | 604.31 g/mol |
| LogP | 1.5787 |
| Topological Polar Surface Area | 228.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 12 |
| Exact Mass | 604.3095 |
| Heavy Atoms | 42 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 69847-42-3 |
|---|---|
| SMILES | CCC(CO)(CO)CO.CC(C)(CO)CO.COC(=O)C1CCC(CC1)C(=O)OC.C1=CC(=CC(=C1)C(=O)O)C(=O)O |
| InChIKey | CAYZNJIYSZJLGF-UHFFFAOYSA-N |
Product Overview
(C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- (CAS 69847-42-3), with molecular formula C29H48O13 and molecular weight 604.31 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;dimethyl cyclohexane-1,4-dicarboxylate;2,2-dimethylpropane-1,3-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol.
Chemical Property Profile of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-
Property Insights of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-
The XLogP value of 1.5787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-. The TPSA of 228.0 Ų indicates high polarity, suggesting (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-?
The CAS number of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- is 69847-42-3.
What is the molecular formula of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-?
The molecular formula of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- is C29H48O13.
What is the molecular weight of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-?
The molecular weight of (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- is 604.31 g/mol.
Where can I buy (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-?
You can request a quote for (C10-H16-O4.C8-H6-O4.C6-H14-O3.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 (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C10-H16-O4.C8-H6-O4.C6-H14-O3.C5-H12-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.