Dimethyl cyclobutane-1,1-dicarboxylate
TL;DR: Dimethyl cyclobutane-1,1-dicarboxylate (CAS 10224-72-3) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl cyclobutane-1,1-dicarboxylate
Also Known As: dimethyl cyclobutane-1,1-dicarboxylate, DIMETHYL 1,1-CYCLOBUTANEDICARBOXYLATE, 1,1-dimethyl cyclobutane-1,1-dicarboxylate, 1,1-Cyclobutanedicarboxylic acid, 1,1-dimethyl ester, 4-(4-Isocyanatophenoxy)tetrahydropyran
| Molecular Formula | C8H12O4 |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 0.5027 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.07356 |
| Heavy Atoms | 12 |
| Complexity | 187.1034 |
Chemical Identifiers
| CAS Number | 10224-72-3 |
|---|---|
| SMILES | COC(=O)C1(CCC1)C(=O)OC |
Product Overview
Dimethyl cyclobutane-1,1-dicarboxylate (CAS 10224-72-3), with molecular formula C8H12O4 and molecular weight 172.07 g/mol. IUPAC: dimethyl cyclobutane-1,1-dicarboxylate.
Chemical Property Profile of Dimethyl cyclobutane-1,1-dicarboxylate
Property Insights of Dimethyl cyclobutane-1,1-dicarboxylate
The XLogP value of 0.5027 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl cyclobutane-1,1-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl cyclobutane-1,1-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl cyclobutane-1,1-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 cyclobutane-1,1-dicarboxylate?
The CAS number of Dimethyl cyclobutane-1,1-dicarboxylate is 10224-72-3.
What is the molecular formula of Dimethyl cyclobutane-1,1-dicarboxylate?
The molecular formula of Dimethyl cyclobutane-1,1-dicarboxylate is C8H12O4.
What is the molecular weight of Dimethyl cyclobutane-1,1-dicarboxylate?
The molecular weight of Dimethyl cyclobutane-1,1-dicarboxylate is 172.07 g/mol.
Where can I buy Dimethyl cyclobutane-1,1-dicarboxylate?
You can request a quote for Dimethyl cyclobutane-1,1-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl cyclobutane-1,1-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl cyclobutane-1,1-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.