Phenyl 3-phenyloxirane-2-carboxylate
TL;DR: Phenyl 3-phenyloxirane-2-carboxylate (CAS 83668-92-2) is a chemical compound with molecular formula C15H12O3 and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 3-phenyloxirane-2-carboxylate
Also Known As: phenyl 3-phenyloxirane-2-carboxylate, trans-Epoxyzimtsaeurephenylester, 3-Phenyloxiranecarboxylic acid phenyl ester, J1.237.646D, 2-Oxiranecarboxylicacid, 3-phenyl-, phenyl ester
| Molecular Formula | C15H12O3 |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.07864 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 83668-92-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(O2)C(=O)OC3=CC=CC=C3 |
| InChIKey | GBQMNXWHCORGMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenyl 3-phenyloxirane-2-carboxylate (CAS 83668-92-2), with molecular formula C15H12O3 and molecular weight 240.08 g/mol. IUPAC: phenyl 3-phenyloxirane-2-carboxylate.
Chemical Property Profile of Phenyl 3-phenyloxirane-2-carboxylate
Property Insights of Phenyl 3-phenyloxirane-2-carboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl 3-phenyloxirane-2-carboxylate. With a topological polar surface area (TPSA) of 38.8 Ų, Phenyl 3-phenyloxirane-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 3-phenyloxirane-2-carboxylate 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 Phenyl 3-phenyloxirane-2-carboxylate?
The CAS number of Phenyl 3-phenyloxirane-2-carboxylate is 83668-92-2.
What is the molecular formula of Phenyl 3-phenyloxirane-2-carboxylate?
The molecular formula of Phenyl 3-phenyloxirane-2-carboxylate is C15H12O3.
What is the molecular weight of Phenyl 3-phenyloxirane-2-carboxylate?
The molecular weight of Phenyl 3-phenyloxirane-2-carboxylate is 240.08 g/mol.
Where can I buy Phenyl 3-phenyloxirane-2-carboxylate?
You can request a quote for Phenyl 3-phenyloxirane-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 3-phenyloxirane-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 3-phenyloxirane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.