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6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one
TL;DR: 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one (CAS 148706-16-5) is a chemical compound with molecular formula C11H9NO2 and molecular weight 187.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-6-oxa-4-azaspiro[2.4]hept-4-en-7-one
Also Known As: 6-phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one, 5-Phenyl-6-oxa-4-aza-spiro[2.4]hept-4-en-7-one, 5-phenyl-6-oxa-4-azaspiro[2.4]hept-4-en-7-one
| Molecular Formula | C11H9NO2 |
|---|---|
| Molecular Weight | 187.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.06332 |
| Heavy Atoms | 14 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 148706-16-5 |
|---|---|
| SMILES | C1CC12C(=O)OC(=N2)C3=CC=CC=C3 |
| InChIKey | BGLLCYNAEQRVGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one (CAS 148706-16-5), with molecular formula C11H9NO2 and molecular weight 187.06 g/mol. IUPAC: 5-phenyl-6-oxa-4-azaspiro[2.4]hept-4-en-7-one.
Chemical Property Profile of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one
Property Insights of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one. With a topological polar surface area (TPSA) of 38.7 Ų, 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one 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 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one?
The CAS number of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one is 148706-16-5.
What is the molecular formula of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one?
The molecular formula of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one is C11H9NO2.
What is the molecular weight of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one?
The molecular weight of 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one is 187.06 g/mol.
Where can I buy 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one?
You can request a quote for 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenyl-5-oxa-7-azaspiro[2.4]hept-6-en-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.