3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate
TL;DR: 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate (CAS 306935-15-9) is a chemical compound with molecular formula C11H17O4- and molecular weight 213.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate
Also Known As: 3-(methoxycarbonyl)-1,2,2-trimethylcyclopentanecarboxylic acid, AF-399/14031056, 3-methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate
| Molecular Formula | C11H17O4- |
|---|---|
| Molecular Weight | 213.11 g/mol |
| LogP | 0.3518 |
| Topological Polar Surface Area | 66.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.11269 |
| Heavy Atoms | 15 |
| Complexity | 294.96304 |
Chemical Identifiers
| CAS Number | 306935-15-9 |
|---|---|
| SMILES | CC1(C(CCC1(C)C(=O)[O-])C(=O)OC)C |
Product Overview
3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate (CAS 306935-15-9), with molecular formula C11H17O4- and molecular weight 213.11 g/mol. IUPAC: 3-methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate.
Chemical Property Profile of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate
Property Insights of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate
The XLogP value of 0.3518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate. The TPSA of 66.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate. Following Lipinski's Rule of Five, 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate 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
Frequently Asked Questions
What is the CAS number of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate?
The CAS number of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate is 306935-15-9.
What is the molecular formula of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate?
The molecular formula of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate is C11H17O4-.
What is the molecular weight of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate?
The molecular weight of 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate is 213.11 g/mol.
Where can I buy 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate?
You can request a quote for 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.