Ethyl trans-chrysanthemate
TL;DR: Ethyl trans-chrysanthemate (CAS 41641-25-2) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-ethyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: Ethyl trans-chrysanthemate, Ethyl chrysanthemate, Ethyl trans-(+)-chrysanthemate, trans-Chrysanthemic acid ethyl ester, Ethyl trans-(+)-chrysanthemumate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 41641-25-2 |
|---|---|
| SMILES | CCOC(=O)[C@@H]1[C@H](C1(C)C)C=C(C)C |
| InChIKey | VIMXTGUGWLAOFZ-ZJUUUORDSA-N |
Product Overview
Ethyl trans-chrysanthemate (CAS 41641-25-2), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: cis-ethyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of Ethyl trans-chrysanthemate
Property Insights of Ethyl trans-chrysanthemate
The XLogP value of 4.1 indicates that Ethyl trans-chrysanthemate 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 trans-chrysanthemate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl trans-chrysanthemate 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 Ethyl trans-chrysanthemate?
The CAS number of Ethyl trans-chrysanthemate is 41641-25-2.
What is the molecular formula of Ethyl trans-chrysanthemate?
The molecular formula of Ethyl trans-chrysanthemate is C12H20O2.
What is the molecular weight of Ethyl trans-chrysanthemate?
The molecular weight of Ethyl trans-chrysanthemate is 196.15 g/mol.
Where can I buy Ethyl trans-chrysanthemate?
You can request a quote for Ethyl trans-chrysanthemate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl trans-chrysanthemate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl trans-chrysanthemate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.