1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester
TL;DR: 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester (CAS 7176-17-2) is a chemical compound with molecular formula C14H20O6 and molecular weight 284.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(oxiran-2-ylmethyl) cyclohexane-1,4-dicarboxylate
Also Known As: bis cyclohexane-1,4-dicarboxylate, 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester, bis(oxiran-2-ylmethyl) cyclohexane-1,4-dicarboxylate, Bis(2,3-oxiranylmethylcyclohexane-1,4-dicarboxylate, Bis[(oxiran-2-yl)methyl] cyclohexane-1,4-dicarboxylate
| Molecular Formula | C14H20O6 |
|---|---|
| Molecular Weight | 284.13 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 284.12598 |
| Heavy Atoms | 20 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 7176-17-2 |
|---|---|
| SMILES | C1CC(CCC1C(=O)OCC2CO2)C(=O)OCC3CO3 |
| InChIKey | HGXHJQLDZPXEOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester (CAS 7176-17-2), with molecular formula C14H20O6 and molecular weight 284.13 g/mol. IUPAC: bis(oxiran-2-ylmethyl) cyclohexane-1,4-dicarboxylate.
Chemical Property Profile of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester
Property Insights of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester. Following Lipinski's Rule of Five, 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester has 0 hydrogen bond donor(s) and 6 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 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester?
The CAS number of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester is 7176-17-2.
What is the molecular formula of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester?
The molecular formula of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester is C14H20O6.
What is the molecular weight of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester?
The molecular weight of 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester is 284.13 g/mol.
Where can I buy 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester?
You can request a quote for 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Cyclohexanedicarboxylic acid, bis(oxiranylmethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.