1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester
TL;DR: 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester (CAS 74837-16-4) is a chemical compound with molecular formula C14H22O5 and molecular weight 270.14673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[3-(3-methoxy-3-oxopropyl)-2-oxocyclohexyl]propanoate
Also Known As: 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester, KST-1B8370, J3.265.518A, methyl 3-[3-(3-methoxy-3-oxopropyl)-2-oxocyclohexyl]propanoate, 2-Oxocyclohexane-1,3-bispropanoic acid dimethyl ester
Technical Specifications
| Molecular Formula | C14H22O5 |
| Molecular Weight | 270.14673 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 270.14673 Da |
| Heavy Atoms | 19 |
| Complexity | 307.0 |
| SMILES | COC(=O)CCC1CCCC(C1=O)CCC(=O)OC |
| InChIKey | DJURADWGRQFBAB-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester
Property Insights of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester. Following Lipinski's Rule of Five, 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester?
The CAS number of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester is 74837-16-4.
What is the molecular formula of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester?
The molecular formula of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester is C14H22O5.
What is the molecular weight of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester?
The molecular weight of 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester is 270.14673 g/mol.
Where can I buy 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester?
You can request a quote for 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester?
Yes, CoreyChem provides custom synthesis services for 1,3-Cyclohexanedipropanoic acid, 2-oxo-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.