(1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate
TL;DR: (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate (CAS 53120-57-3) is a chemical compound with molecular formula C18H20O10 and molecular weight 396.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate
Also Known As: TimTec1_001255, (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate, tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate, BAS 00666623, tetramethyl -2,6-dioxoadamantane-1,3,5,7-tetracarboxylate
| Molecular Formula | C18H20O10 |
|---|---|
| Molecular Weight | 396.11 g/mol |
| LogP | -0.6366 |
| Topological Polar Surface Area | 139.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.10565 |
| Heavy Atoms | 28 |
| Complexity | 682.22296 |
Chemical Identifiers
| CAS Number | 53120-57-3 |
|---|---|
| SMILES | COC(=O)C12CC3(CC(C1=O)(CC(C2)(C3=O)C(=O)OC)C(=O)OC)C(=O)OC |
Product Overview
(1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate (CAS 53120-57-3), with molecular formula C18H20O10 and molecular weight 396.11 g/mol. IUPAC: tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate.
Chemical Property Profile of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate
Property Insights of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate
The XLogP value of -0.6366 indicates that (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 139.34 Ų falls within the moderate polarity range, balancing permeability and solubility for (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate. Following Lipinski's Rule of Five, (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate has 0 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 (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate?
The CAS number of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate is 53120-57-3.
What is the molecular formula of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate?
The molecular formula of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate is C18H20O10.
What is the molecular weight of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate?
The molecular weight of (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate is 396.11 g/mol.
Where can I buy (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate?
You can request a quote for (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate?
Yes, KEHONG BIO provides custom synthesis services for (1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.