Dimethyl 3,8-dioxodecanedioate
TL;DR: Dimethyl 3,8-dioxodecanedioate (CAS 55030-37-0) is a chemical compound with molecular formula C12H18O6 and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3,8-dioxodecanedioate
Also Known As: Dimethyl 3,8-dioxodecanedioate, 3,8-Dioxodecanedioicaciddimethylester, Dimethyl 3,8-dioxodecanedioate #, 3,8-Dioxodecanedioic acid dimethyl ester, 1,10-dimethyl 3,8-dioxodecanedioate
| Molecular Formula | C12H18O6 |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 258.11035 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 55030-37-0 |
|---|---|
| SMILES | COC(=O)CC(=O)CCCCC(=O)CC(=O)OC |
| InChIKey | BVFKBKVCRSXUAA-UHFFFAOYSA-N |
Product Overview
Dimethyl 3,8-dioxodecanedioate (CAS 55030-37-0), with molecular formula C12H18O6 and molecular weight 258.11 g/mol. IUPAC: dimethyl 3,8-dioxodecanedioate.
Chemical Property Profile of Dimethyl 3,8-dioxodecanedioate
Property Insights of Dimethyl 3,8-dioxodecanedioate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3,8-dioxodecanedioate. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3,8-dioxodecanedioate. Following Lipinski's Rule of Five, Dimethyl 3,8-dioxodecanedioate 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 Dimethyl 3,8-dioxodecanedioate?
The CAS number of Dimethyl 3,8-dioxodecanedioate is 55030-37-0.
What is the molecular formula of Dimethyl 3,8-dioxodecanedioate?
The molecular formula of Dimethyl 3,8-dioxodecanedioate is C12H18O6.
What is the molecular weight of Dimethyl 3,8-dioxodecanedioate?
The molecular weight of Dimethyl 3,8-dioxodecanedioate is 258.11 g/mol.
Where can I buy Dimethyl 3,8-dioxodecanedioate?
You can request a quote for Dimethyl 3,8-dioxodecanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3,8-dioxodecanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3,8-dioxodecanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.