1-Methyl-1,2-trans-cyclopropane dicarboxylic acid
TL;DR: 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid (CAS 14590-54-6) is a chemical compound with molecular formula C6H8O4 and molecular weight 144.04225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trans-(1S,2S)-1-methylcyclopropane-1,2-dicarboxylic acid
Also Known As: 1-Methyl-1,2-cyclopropanedicarboxylic acid #, 1-Methyl-1,2-cis-cyclopropane dicarboxylic acid, 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid, (1S,2S)-1-methylcyclopropane-1,2-dicarboxylic acid
Technical Specifications
| Molecular Formula | C6H8O4 |
| Molecular Weight | 144.04225 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 144.04225 Da |
| Heavy Atoms | 10 |
| Complexity | 198.0 |
| SMILES | C[C@@]1(C[C@@H]1C(=O)O)C(=O)O |
| InChIKey | CUXGZYHWQYTLKE-CVYQJGLWSA-N |
Chemical Property Profile of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid
Property Insights of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid
The XLogP value of -0.2 indicates that 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid. Following Lipinski's Rule of Five, 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid has 2 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-Methyl-1,2-trans-cyclopropane dicarboxylic acid?
The CAS number of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid is 14590-54-6.
What is the molecular formula of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid?
The molecular formula of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid is C6H8O4.
What is the molecular weight of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid?
The molecular weight of 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid is 144.04225 g/mol.
Where can I buy 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid?
You can request a quote for 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-1,2-trans-cyclopropane dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.