Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-
TL;DR: Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- (CAS 2272-49-3) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S,3R)-3-phenyloxirane-2-carboxylate
Also Known As: Ethyl 3-phenylglycidate, GOMAKLPNAAZVCJ-ZJUUUORDSA-, (2s,3r)-ethyl 3-phenylglycidate, Glycidic acid, ethyl ester, trans-, Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 2272-49-3 |
|---|---|
| SMILES | CCOC(=O)[C@@H]1[C@H](O1)C2=CC=CC=C2 |
| InChIKey | GOMAKLPNAAZVCJ-ZJUUUORDSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- (CAS 2272-49-3), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: ethyl (2S,3R)-3-phenyloxirane-2-carboxylate.
Chemical Property Profile of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-
Property Insights of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-. With a topological polar surface area (TPSA) of 38.8 Ų, Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- has 0 hydrogen bond donor(s) and 3 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 Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-?
The CAS number of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- is 2272-49-3.
What is the molecular formula of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-?
The molecular formula of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- is C11H12O3.
What is the molecular weight of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-?
The molecular weight of Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- is 192.08 g/mol.
Where can I buy Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-?
You can request a quote for Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans-?
Yes, KEHONG BIO provides custom synthesis services for Oxiranecarboxylic acid, 3-phenyl-, ethyl ester, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.