ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate
TL;DR: ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate (CAS 2380902-05-4) is a chemical compound with molecular formula C12H13FO2 and molecular weight 208.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate
Also Known As: ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate, J1.786.975B, ethyl (1S,2R)-2-fluoro-2-phenyl-cyclopropanecarboxylate, 2alpha-Fluoro-2-phenylcyclopropane-1beta-carboxylic acid ethyl ester, Cyclopropanecarboxylic acid, 2-fluoro-2-phenyl-, ethyl ester, (1S,2S)-
| Molecular Formula | C12H13FO2 |
|---|---|
| Molecular Weight | 208.09 g/mol |
| LogP | 2.4344 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.08995 |
| Heavy Atoms | 15 |
| Complexity | 363.14468 |
Chemical Identifiers
| CAS Number | 2380902-05-4 |
|---|---|
| SMILES | CCOC(=O)[C@@H]1C[C@@]1(C2=CC=CC=C2)F |
Product Overview
ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate (CAS 2380902-05-4), with molecular formula C12H13FO2 and molecular weight 208.09 g/mol. IUPAC: trans-ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate.
Chemical Property Profile of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate
Property Insights of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate
The XLogP value of 2.4344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate 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 (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate?
The CAS number of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate is 2380902-05-4.
What is the molecular formula of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate?
The molecular formula of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate is C12H13FO2.
What is the molecular weight of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate?
The molecular weight of ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate is 208.09 g/mol.
Where can I buy ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate?
You can request a quote for ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-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 (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (1S,2R)-2-fluoro-2-phenylcyclopropane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.