![3-[(4-Methylphenyl)methylidene]oxolan-2-one structure](/static/products/5418/5418-24-6.webp)
3-[(4-Methylphenyl)methylidene]oxolan-2-one
TL;DR: 3-[(4-Methylphenyl)methylidene]oxolan-2-one (CAS 5418-24-6) 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.
3-[(4-methylphenyl)methylidene]oxolan-2-one
Also Known As: 3-[(4-methylphenyl)methylidene]oxolan-2-one, 3-(4-methylbenzylidene)dihydrofuran-2(3h)-one, 3-(4-Methylbenzylidene)dihydro-2(3H)-furanone, 2(3H)-Furanone,dihydro-3-[(4-methylphenyl)methylene]-
| Molecular Formula | C12H12O2 |
|---|---|
| Molecular Weight | 188.08 g/mol |
| LogP | 2.6 |
| 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 | 247.0 |
Chemical Identifiers
| CAS Number | 5418-24-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C=C2CCOC2=O |
| InChIKey | DZQULPJCBCHNSJ-UHFFFAOYSA-N |
Product Overview
3-[(4-Methylphenyl)methylidene]oxolan-2-one (CAS 5418-24-6), with molecular formula C12H12O2 and molecular weight 188.08 g/mol. IUPAC: 3-[(4-methylphenyl)methylidene]oxolan-2-one.
Chemical Property Profile of 3-[(4-Methylphenyl)methylidene]oxolan-2-one
Property Insights of 3-[(4-Methylphenyl)methylidene]oxolan-2-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Methylphenyl)methylidene]oxolan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 3-[(4-Methylphenyl)methylidene]oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Methylphenyl)methylidene]oxolan-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 3-[(4-Methylphenyl)methylidene]oxolan-2-one?
The CAS number of 3-[(4-Methylphenyl)methylidene]oxolan-2-one is 5418-24-6.
What is the molecular formula of 3-[(4-Methylphenyl)methylidene]oxolan-2-one?
The molecular formula of 3-[(4-Methylphenyl)methylidene]oxolan-2-one is C12H12O2.
What is the molecular weight of 3-[(4-Methylphenyl)methylidene]oxolan-2-one?
The molecular weight of 3-[(4-Methylphenyl)methylidene]oxolan-2-one is 188.08 g/mol.
Where can I buy 3-[(4-Methylphenyl)methylidene]oxolan-2-one?
You can request a quote for 3-[(4-Methylphenyl)methylidene]oxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Methylphenyl)methylidene]oxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methylphenyl)methylidene]oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.