5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one
TL;DR: 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one (CAS 63506-92-3) is a chemical compound with molecular formula C13H14O2 and molecular weight 202.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-3-methylidene-4-phenyloxolan-2-one
Also Known As: 5,5-dimethyl-3-methylidene-4-phenyloxolan-2-one, 5,5-dimethyl-3-methylene-4-phenyl-tetrahydrofuran-2-one, 5,5-Dimethyl-3-methylene-4-phenyldihydrofuran-2(3H)-one
| Molecular Formula | C13H14O2 |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.09938 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 63506-92-3 |
|---|---|
| SMILES | CC1(C(C(=C)C(=O)O1)C2=CC=CC=C2)C |
| InChIKey | SYKAFLOVDXCZNR-UHFFFAOYSA-N |
Product Overview
5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one (CAS 63506-92-3), with molecular formula C13H14O2 and molecular weight 202.10 g/mol. IUPAC: 5,5-dimethyl-3-methylidene-4-phenyloxolan-2-one.
Chemical Property Profile of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one
Property Insights of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one 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 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one?
The CAS number of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one is 63506-92-3.
What is the molecular formula of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one?
The molecular formula of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one is C13H14O2.
What is the molecular weight of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one?
The molecular weight of 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one is 202.10 g/mol.
Where can I buy 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one?
You can request a quote for 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-3-methylidene-4-phenyloxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.