5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone
TL;DR: 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone (CAS 55669-89-1) 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-(2,5-dimethylphenyl)-4-methyl-3H-furan-2-one
Also Known As: 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone, 2(3H)-Furanone, 5-(2,5-dimethylphenyl)-4-methyl-, 5-(2,5-dimethylphenyl)-4-methyl-3H-furan-2-one, 5-(2,5-Dimethylphenyl)-4-methylfuran-2(3H)-one, 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone #
| Molecular Formula | C13H14O2 |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 2.5 |
| 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 | 304.0 |
Chemical Identifiers
| CAS Number | 55669-89-1 |
|---|---|
| SMILES | CC1=C(OC(=O)C1)C2=C(C=CC(=C2)C)C |
| InChIKey | YSGQGJXAHGKEIC-UHFFFAOYSA-N |
Product Overview
5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone (CAS 55669-89-1), with molecular formula C13H14O2 and molecular weight 202.10 g/mol. IUPAC: 5-(2,5-dimethylphenyl)-4-methyl-3H-furan-2-one.
Chemical Property Profile of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone
Property Insights of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone. With a topological polar surface area (TPSA) of 26.3 Ų, 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone 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-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone?
The CAS number of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone is 55669-89-1.
What is the molecular formula of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone?
The molecular formula of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone is C13H14O2.
What is the molecular weight of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone?
The molecular weight of 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone is 202.10 g/mol.
Where can I buy 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone?
You can request a quote for 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone?
Yes, KEHONG BIO provides custom synthesis services for 5-(2,5-Dimethylphenyl)-4-methyl-2(3H)-furanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.