2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-
TL;DR: 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- (CAS 40870-53-9) is a chemical compound with molecular formula C11H12O6 and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dimethoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl acetate
Also Known As: 2,6-Dimethoxy-3-acetoxymethyl-p-benzoquinone, 2,6-Dimethoxy-3-acetoxymethyl-1,4-benzoquinone, (2,4-dimethoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl acetate, p-Benzoquinone, 2,6-dimethoxy-3-(hydroxymethyl)-, acetate (ester), 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-
| Molecular Formula | C11H12O6 |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.06339 |
| Heavy Atoms | 17 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 40870-53-9 |
|---|---|
| SMILES | CC(=O)OCC1=C(C(=O)C(=CC1=O)OC)OC |
| InChIKey | YNXJUWMWAFIYAJ-UHFFFAOYSA-N |
Product Overview
2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- (CAS 40870-53-9), with molecular formula C11H12O6 and molecular weight 240.06 g/mol. IUPAC: (2,4-dimethoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl acetate.
Chemical Property Profile of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-
Property Insights of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-
The XLogP value of -0.3 indicates that 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-. Following Lipinski's Rule of Five, 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- 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 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-?
The CAS number of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- is 40870-53-9.
What is the molecular formula of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-?
The molecular formula of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- is C11H12O6.
What is the molecular weight of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-?
The molecular weight of 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- is 240.06 g/mol.
Where can I buy 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-?
You can request a quote for 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Cyclohexadiene-1,4-dione, 2-((acetyloxy)methyl)-3,5-dimethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.