RefChem:581168
TL;DR: RefChem:581168 (CAS 63142-56-3) is a chemical compound with molecular formula C10H14Cl2O2 and molecular weight 236.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-ethyl (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Also Known As: Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, ethyl ester, (1R,3R)-rel-, ethyl(1r,3r)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate, Ethyl cis-2-(2,2-dichlorovinyl)-3,3-dimethylcyclopropanecarboxylate, Ethyl cis-(+/-)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate, Ethyl cis-(1)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate
| Molecular Formula | C10H14Cl2O2 |
|---|---|
| Molecular Weight | 236.04 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.03708 |
| Heavy Atoms | 14 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 63142-56-3 |
|---|---|
| SMILES | CCOC(=O)[C@@H]1[C@@H](C1(C)C)C=C(Cl)Cl |
| InChIKey | QPTWKDNRYCGMJM-XPUUQOCRSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:581168 (CAS 63142-56-3), with molecular formula C10H14Cl2O2 and molecular weight 236.04 g/mol. IUPAC: trans-ethyl (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate.
Chemical Property Profile of RefChem:581168
Property Insights of RefChem:581168
The XLogP value of 4.0 indicates that RefChem:581168 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, RefChem:581168 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:581168 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 RefChem:581168?
The CAS number of RefChem:581168 is 63142-56-3.
What is the molecular formula of RefChem:581168?
The molecular formula of RefChem:581168 is C10H14Cl2O2.
What is the molecular weight of RefChem:581168?
The molecular weight of RefChem:581168 is 236.04 g/mol.
Where can I buy RefChem:581168?
You can request a quote for RefChem:581168 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:581168?
Yes, KEHONG BIO provides custom synthesis services for RefChem:581168 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.