![dimethyl [?]dicarboxylate structure](/static/products/1627/162739-42-6.webp)
dimethyl [?]dicarboxylate
TL;DR: dimethyl [?]dicarboxylate (CAS 162739-42-6) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl tetracyclo[4.3.0.02,4.03,7]non-8-ene-8,9-dicarboxylate
Also Known As: dimethyl [?]dicarboxylate, KST-1B0816, RCL L160660, 1,2,4-Methenopentalene-5,6-dicarboxylic acid, 1,2,3,3a,4,6a-hexahydro-, dimethyl ester, AB-131/42302829
Technical Specifications
| Molecular Formula | C13H14O4 |
| Molecular Weight | 234.0892 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.0892 Da |
| Heavy Atoms | 17 |
| Complexity | 438.0 |
| SMILES | COC(=O)C1=C(C2C3C1C4C2C4C3)C(=O)OC |
| InChIKey | YZQAUJSISPRMIU-UHFFFAOYSA-N |
Chemical Property Profile of dimethyl [?]dicarboxylate
Property Insights of dimethyl [?]dicarboxylate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl [?]dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, dimethyl [?]dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dimethyl [?]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 dimethyl [?]dicarboxylate?
The CAS number of dimethyl [?]dicarboxylate is 162739-42-6.
What is the molecular formula of dimethyl [?]dicarboxylate?
The molecular formula of dimethyl [?]dicarboxylate is C13H14O4.
What is the molecular weight of dimethyl [?]dicarboxylate?
The molecular weight of dimethyl [?]dicarboxylate is 234.0892 g/mol.
Where can I buy dimethyl [?]dicarboxylate?
You can request a quote for dimethyl [?]dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for dimethyl [?]dicarboxylate?
Yes, CoreyChem provides custom synthesis services for dimethyl [?]dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.