myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane
TL;DR: myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane (CAS 77117-51-2) is a chemical compound with molecular formula C18H24O12 and molecular weight 432.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexamethyl cyclohexane-1,2,3,4,5,6-hexacarboxylate
Also Known As: myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane, hexamethyl cyclohexane-1,2,3,4,5,6-hexacarboxylate, Hexamethyl (1s,2s,3s,4s,5s,6s)-cyclohexane-1,2,3,4,5,6-hexacarboxylate, 1,2,3,4,5,6-Cyclohexanehexacarboxylic acid, hexamethyl ester, (1I+/-,2I+/-,3I+/-,4I+/-,5I+/-,6I+/-)-
| Molecular Formula | C18H24O12 |
|---|---|
| Molecular Weight | 432.13 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 432.12677 |
| Heavy Atoms | 30 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 77117-51-2 |
|---|---|
| SMILES | COC(=O)C1C(C(C(C(C1C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC |
| InChIKey | SMQNRPXTRPQGCL-UHFFFAOYSA-N |
Product Overview
myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane (CAS 77117-51-2), with molecular formula C18H24O12 and molecular weight 432.13 g/mol. IUPAC: hexamethyl cyclohexane-1,2,3,4,5,6-hexacarboxylate.
Chemical Property Profile of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane
Property Insights of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane
The XLogP value of -0.8 indicates that myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.0 Ų indicates high polarity, suggesting myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane?
The CAS number of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane is 77117-51-2.
What is the molecular formula of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane?
The molecular formula of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane is C18H24O12.
What is the molecular weight of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane?
The molecular weight of myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane is 432.13 g/mol.
Where can I buy myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane?
You can request a quote for myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for myo-1,2,3,4,5,6-Hexamethoxycarbonylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.