Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
TL;DR: Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate (CAS 99903-43-2) is a chemical compound with molecular formula C10H8Cl2F6O2 and molecular weight 343.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
Also Known As: Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate, ethyl 3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate, Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)-, ethyl ester, trans-?, Ethyl (1R,3S)-3-(2,2-dichloroethen-1-yl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
| Molecular Formula | C10H8Cl2F6O2 |
|---|---|
| Molecular Weight | 343.98 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.98056 |
| Heavy Atoms | 20 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 99903-43-2 |
|---|---|
| SMILES | CCOC(=O)[C@@H]1[C@H](C1(C(F)(F)F)C(F)(F)F)C=C(Cl)Cl |
| InChIKey | IMZWPBWPEDGHRD-XINAWCOVSA-N |
Product Overview
Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate (CAS 99903-43-2), with molecular formula C10H8Cl2F6O2 and molecular weight 343.98 g/mol. IUPAC: cis-ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate.
Chemical Property Profile of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
Property Insights of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate
The XLogP value of 4.6 indicates that Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate has 0 hydrogen bond donor(s) and 8 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 Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate?
The CAS number of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate is 99903-43-2.
What is the molecular formula of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate?
The molecular formula of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate is C10H8Cl2F6O2.
What is the molecular weight of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate?
The molecular weight of Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate is 343.98 g/mol.
Where can I buy Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate?
You can request a quote for Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-bis(trifluoromethyl)cyclopropane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.