1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate
TL;DR: 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate (CAS 1128-10-5) is a chemical compound with molecular formula C8H10O4 and molecular weight 170.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl cyclobutene-1,2-dicarboxylate
Also Known As: Dimethyl cyclobut-1-ene-1,2-dicarboxylate, dimethyl cyclobutene-1,2-dicarboxylate, AMY701, 1,2-dimethyl cyclobut-1-ene-1,2-dicarboxylate, Cyclobutene-1,2-dicarboxylic acid dimethyl ester
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H10O4 |
| Molecular Weight | 170.0579 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.0579 Da |
| Heavy Atoms | 12 |
| Complexity | 226.0 |
| SMILES | COC(=O)C1=C(CC1)C(=O)OC |
| InChIKey | YCWIAJMHYRJHSR-UHFFFAOYSA-N |
Chemical Property Profile of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate
Property Insights of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dimethyl cyclobut-1-ene-1,2-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 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate?
The CAS number of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate is 1128-10-5.
What is the molecular formula of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate?
The molecular formula of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate is C8H10O4.
What is the molecular weight of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate?
The molecular weight of 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate is 170.0579 g/mol.
Where can I buy 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate?
You can request a quote for 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate?
Yes, CoreyChem provides custom synthesis services for 1,2-Dimethyl cyclobut-1-ene-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.