2,2-二甲基环丙烷甲酸乙酯
TL;DR: 2,2-二甲基环丙烷甲酸乙酯 (CAS 16783-11-2) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-二甲基环丙烷甲酸乙酯
ethyl 2,2-dimethylcyclopropane-1-carboxylate
Also Known As: Ethyl 2,2-dimethylcyclopropanecarboxylate, ethyl 2,2-dimethylcyclopropane-1-carboxylate, 2,2-Dimethyl-cyclopropanecarboxylic acid ethyl ester, ethyl-2,2-dimethylcyclopropanecarboxylate, Cyclopropanecarboxylic acid, 2,2-dimethyl-, ethyl ester
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 16783-11-2 |
|---|---|
| SMILES | CCOC(=O)C1CC1(C)C |
| InChIKey | OMQDMPAJKBUQSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-二甲基环丙烷甲酸乙酯 (CAS 16783-11-2), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: ethyl 2,2-dimethylcyclopropane-1-carboxylate.
Chemical Property Profile of 2,2-二甲基环丙烷甲酸乙酯
Property Insights of 2,2-二甲基环丙烷甲酸乙酯
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-二甲基环丙烷甲酸乙酯. With a topological polar surface area (TPSA) of 26.3 Ų, 2,2-二甲基环丙烷甲酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-二甲基环丙烷甲酸乙酯 has 0 hydrogen bond donor(s) and 2 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 2,2-二甲基环丙烷甲酸乙酯?
The CAS number of 2,2-二甲基环丙烷甲酸乙酯 is 16783-11-2.
What is the molecular formula of 2,2-二甲基环丙烷甲酸乙酯?
The molecular formula of 2,2-二甲基环丙烷甲酸乙酯 is C8H14O2.
What is the molecular weight of 2,2-二甲基环丙烷甲酸乙酯?
The molecular weight of 2,2-二甲基环丙烷甲酸乙酯 is 142.10 g/mol.
Where can I buy 2,2-二甲基环丙烷甲酸乙酯?
You can request a quote for 2,2-二甲基环丙烷甲酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-二甲基环丙烷甲酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 2,2-二甲基环丙烷甲酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.