3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one
TL;DR: 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one (CAS 396102-19-5) is a chemical compound with molecular formula C15H18O3 and molecular weight 246.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3-dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one
Also Known As: 3-(2,3-dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one, J1.640.754B, 2-cyclopenten-1-one, 3-(2,3-dimethoxy-5-methylphenyl)-2-methyl-, 2-methyl-3-(2,3-dimethoxy-5-methyl)phenyl-2-cyclopentenone, 2-Methyl-3-(2,3-dimethoxy-5-methylphenyl)-2-cyclopentene-1-one
| Molecular Formula | C15H18O3 |
|---|---|
| Molecular Weight | 246.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.1256 |
| Heavy Atoms | 18 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 396102-19-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)OC)OC)C2=C(C(=O)CC2)C |
| InChIKey | CADDKFQKXHSJCP-UHFFFAOYSA-N |
Product Overview
3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one (CAS 396102-19-5), with molecular formula C15H18O3 and molecular weight 246.13 g/mol. IUPAC: 3-(2,3-dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one.
Chemical Property Profile of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one
Property Insights of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one. With a topological polar surface area (TPSA) of 35.5 Ų, 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one has 0 hydrogen bond donor(s) and 3 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-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one?
The CAS number of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one is 396102-19-5.
What is the molecular formula of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one?
The molecular formula of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one is C15H18O3.
What is the molecular weight of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one?
The molecular weight of 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one is 246.13 g/mol.
Where can I buy 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one?
You can request a quote for 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3-Dimethoxy-5-methylphenyl)-2-methylcyclopent-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.