1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate
TL;DR: 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate (CAS 14132-43-5) is a chemical compound with molecular formula C9H14O4 and molecular weight 186.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 2-methylcyclobutane-1,1-dicarboxylate
Also Known As: 1,1-dimethyl 2-methylcyclobutane-1,1-dicarboxylate, dimethyl 2-methylcyclobutane-1,1-dicarboxylate, Dimethyl 2-methyl-1,1-cyclobutanedicarboxylate, 2-Methyl-1,1-cyclobutanedicarboxylic acid dimethyl ester, 1,1-dimethyl2-methylcyclobutane-1,1-dicarboxylate
Technical Specifications
| Molecular Formula | C9H14O4 |
| Molecular Weight | 186.0892 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.0892 Da |
| Heavy Atoms | 13 |
| Complexity | 218.0 |
| SMILES | CC1CCC1(C(=O)OC)C(=O)OC |
| InChIKey | OQTZRIUJDWUIFM-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate
Property Insights of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethyl 2-methylcyclobutane-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
What is the CAS number of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate?
The CAS number of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate is 14132-43-5.
What is the molecular formula of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate?
The molecular formula of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate is C9H14O4.
What is the molecular weight of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate?
The molecular weight of 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate is 186.0892 g/mol.
Where can I buy 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate?
You can request a quote for 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate?
Yes, CoreyChem provides custom synthesis services for 1,1-Dimethyl 2-methylcyclobutane-1,1-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.