![3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one structure](/static/products/5443/5443-11-8.webp)
3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one
TL;DR: 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one (CAS 5443-11-8) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one
Also Known As: 3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one, 3-(3,4-dimethoxybenzylidene)dihydrofuran-2(3h)-one, (3E)-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one, Pentanamide, N-(4-amino-6-propyl-1,3,5-triazin-2-yl)-
| Molecular Formula | C13H14O4 |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.0892 |
| Heavy Atoms | 17 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 5443-11-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=C2CCOC2=O)OC |
| InChIKey | ZRJQYVDRCJESNN-UHFFFAOYSA-N |
Product Overview
3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one (CAS 5443-11-8), with molecular formula C13H14O4 and molecular weight 234.09 g/mol. IUPAC: 3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one.
Chemical Property Profile of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one
Property Insights of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one. With a topological polar surface area (TPSA) of 44.8 Ų, 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one has 0 hydrogen bond donor(s) and 4 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-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one?
The CAS number of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one is 5443-11-8.
What is the molecular formula of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one?
The molecular formula of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one is C13H14O4.
What is the molecular weight of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one?
The molecular weight of 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one is 234.09 g/mol.
Where can I buy 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one?
You can request a quote for 3-[(3,4-Dimethoxyphenyl)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-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3,4-Dimethoxyphenyl)methylidene]oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.