Bullatenone
TL;DR: Bullatenone (CAS 493-71-0) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-5-phenylfuran-3-one
Also Known As: Bullatenone, Cerulignone, 2,2-dimethyl-5-phenylfuran-3-one, 3(2H)-Furanone, 2,2-dimethyl-5-phenyl-, 2,2-Dimethyl-5-phenyl-3(2H)-furanone
| Molecular Formula | C12H12O2 |
|---|---|
| Molecular Weight | 188.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.08372 |
| Heavy Atoms | 14 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 493-71-0 |
|---|---|
| SMILES | CC1(C(=O)C=C(O1)C2=CC=CC=C2)C |
| InChIKey | LTRTYBNTZIFLOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bullatenone (CAS 493-71-0), with molecular formula C12H12O2 and molecular weight 188.08 g/mol. IUPAC: 2,2-dimethyl-5-phenylfuran-3-one.
Chemical Property Profile of Bullatenone
Property Insights of Bullatenone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bullatenone. With a topological polar surface area (TPSA) of 26.3 Ų, Bullatenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bullatenone has 0 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 Bullatenone?
The CAS number of Bullatenone is 493-71-0.
What is the molecular formula of Bullatenone?
The molecular formula of Bullatenone is C12H12O2.
What is the molecular weight of Bullatenone?
The molecular weight of Bullatenone is 188.08 g/mol.
Where can I buy Bullatenone?
You can request a quote for Bullatenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bullatenone?
Yes, KEHONG BIO provides custom synthesis services for Bullatenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.