1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester
TL;DR: 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester (CAS 151446-23-0) is a chemical compound with molecular formula C7H10O4 and molecular weight 158.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl cyclopropane-1,1-dicarboxylate
Also Known As: dimethyl cyclopropane-1,1-dicarboxylate, 1,1-Cyclopropanedicarboxylic acid dimethyl ester, Dimethyl 1,1-cyclopropanedicarboxylate, dimethylcyclopropane-1,1-dicarboxylate, Isopropyl hydrogen sulphate
Technical Specifications
| Molecular Formula | C7H10O4 |
| Molecular Weight | 158.0579 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 | 158.0579 Da |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
| SMILES | COC(=O)C1(CC1)C(=O)OC |
| InChIKey | PWLLZZMFFZUSOG-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester
Property Insights of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester 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-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester?
The CAS number of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester is 151446-23-0.
What is the molecular formula of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester?
The molecular formula of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester is C7H10O4.
What is the molecular weight of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester?
The molecular weight of 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester is 158.0579 g/mol.
Where can I buy 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester?
You can request a quote for 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester?
Yes, CoreyChem provides custom synthesis services for 1,1-Cyclopropanedicarboxylic acid, 1,1-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.