3-Phenyloxirane-2-carboxamide
TL;DR: 3-Phenyloxirane-2-carboxamide (CAS 18538-53-9) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyloxirane-2-carboxamide
Also Known As: 3-phenyloxirane-2-carboxamide, Oxiranecarboxamide, 3-phenyl-, Hydrocinnamamide, 2,3-epoxy-, 3-Phenyloxiranecarboxamide, Oxiranecarboxamide, 3-phenyl- (9CI)
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 18538-53-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(O2)C(=O)N |
| InChIKey | WXVCRRFNDGFWQY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenyloxirane-2-carboxamide (CAS 18538-53-9), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: 3-phenyloxirane-2-carboxamide.
Chemical Property Profile of 3-Phenyloxirane-2-carboxamide
Property Insights of 3-Phenyloxirane-2-carboxamide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyloxirane-2-carboxamide. With a topological polar surface area (TPSA) of 55.6 Ų, 3-Phenyloxirane-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyloxirane-2-carboxamide has 1 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 3-Phenyloxirane-2-carboxamide?
The CAS number of 3-Phenyloxirane-2-carboxamide is 18538-53-9.
What is the molecular formula of 3-Phenyloxirane-2-carboxamide?
The molecular formula of 3-Phenyloxirane-2-carboxamide is C9H9NO2.
What is the molecular weight of 3-Phenyloxirane-2-carboxamide?
The molecular weight of 3-Phenyloxirane-2-carboxamide is 163.06 g/mol.
Where can I buy 3-Phenyloxirane-2-carboxamide?
You can request a quote for 3-Phenyloxirane-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyloxirane-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyloxirane-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.