1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-
TL;DR: 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- (CAS 6549-59-3) is a chemical compound with molecular formula C19H18O2 and molecular weight 278.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,5,6-tetramethylphenyl)indene-1,3-dione
Also Known As: 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-, 2-(2,3,5,6-Tetramethylphenyl)-1,3-indandione, 2-(2,3,5,6-tetramethylphenyl)indene-1,3-dione, 1H-Indene-1,3(2H)-dione, 2-(2,3,5,6-tetramethylphenyl)-, 2-(2,3,5,6-Tetramethylphenyl)-1H-indene-1,3(2H)-dione
| Molecular Formula | C19H18O2 |
|---|---|
| Molecular Weight | 278.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.13068 |
| Heavy Atoms | 21 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 6549-59-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C)C2C(=O)C3=CC=CC=C3C2=O)C)C |
| InChIKey | SGBVKPAARRKINA-UHFFFAOYSA-N |
Product Overview
1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- (CAS 6549-59-3), with molecular formula C19H18O2 and molecular weight 278.13 g/mol. IUPAC: 2-(2,3,5,6-tetramethylphenyl)indene-1,3-dione.
Chemical Property Profile of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-
Property Insights of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-
The XLogP value of 4.4 indicates that 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- 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 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-?
The CAS number of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- is 6549-59-3.
What is the molecular formula of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-?
The molecular formula of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- is C19H18O2.
What is the molecular weight of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-?
The molecular weight of 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- is 278.13 g/mol.
Where can I buy 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-?
You can request a quote for 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Indandione, 2-(2,3,5,6-tetramethylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.