2-Oxiranecarboxylic acid, 2-phenylethyl ester
TL;DR: 2-Oxiranecarboxylic acid, 2-phenylethyl ester (CAS 68892-14-8) 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.
2-phenylethyl oxirane-2-carboxylate
Also Known As: Phenethyl glycidate, Oxiranecarboxylic acid, 2-phenylethyl ester, phenethyl oxirane-2-carboxylate, 2-Oxiranecarboxylic acid, 2-phenylethyl ester, 2-PHENYLETHYL OXIRANE-2-CARBOXYLATE
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 68892-14-8 |
|---|---|
| SMILES | C1C(O1)C(=O)OCCC2=CC=CC=C2 |
| InChIKey | UTNDVHQOMQAVKV-UHFFFAOYSA-N |
Product Overview
2-Oxiranecarboxylic acid, 2-phenylethyl ester (CAS 68892-14-8), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 2-phenylethyl oxirane-2-carboxylate.
Chemical Property Profile of 2-Oxiranecarboxylic acid, 2-phenylethyl ester
Property Insights of 2-Oxiranecarboxylic acid, 2-phenylethyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxiranecarboxylic acid, 2-phenylethyl ester. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Oxiranecarboxylic acid, 2-phenylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxiranecarboxylic acid, 2-phenylethyl ester 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 2-Oxiranecarboxylic acid, 2-phenylethyl ester?
The CAS number of 2-Oxiranecarboxylic acid, 2-phenylethyl ester is 68892-14-8.
What is the molecular formula of 2-Oxiranecarboxylic acid, 2-phenylethyl ester?
The molecular formula of 2-Oxiranecarboxylic acid, 2-phenylethyl ester is C11H12O3.
What is the molecular weight of 2-Oxiranecarboxylic acid, 2-phenylethyl ester?
The molecular weight of 2-Oxiranecarboxylic acid, 2-phenylethyl ester is 192.08 g/mol.
Where can I buy 2-Oxiranecarboxylic acid, 2-phenylethyl ester?
You can request a quote for 2-Oxiranecarboxylic acid, 2-phenylethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxiranecarboxylic acid, 2-phenylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxiranecarboxylic acid, 2-phenylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.