2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione
TL;DR: 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione (CAS 54689-99-5) is a chemical compound with molecular formula C20H18O2 and molecular weight 290.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,3,5,6-tetramethylphenyl)methylidene]indene-1,3-dione
Also Known As: 2-(2,3,5,6-Tetramethylbenzylidene)-1H-indene-1,3(2H)-dione, BAS 00127074, BIM-0016564.P001, 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione, 2-[(2,3,5,6-tetramethylphenyl)methylidene]indene-1,3-dione
| Molecular Formula | C20H18O2 |
|---|---|
| Molecular Weight | 290.13 g/mol |
| LogP | 4.38288 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.13068 |
| Heavy Atoms | 22 |
| Complexity | 791.0012 |
Chemical Identifiers
| CAS Number | 54689-99-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C)C=C2C(=O)C3=CC=CC=C3C2=O)C)C |
Product Overview
2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione (CAS 54689-99-5), with molecular formula C20H18O2 and molecular weight 290.13 g/mol. IUPAC: 2-[(2,3,5,6-tetramethylphenyl)methylidene]indene-1,3-dione.
Chemical Property Profile of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione
Property Insights of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione
The XLogP value of 4.38288 indicates that 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione 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 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione?
The CAS number of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione is 54689-99-5.
What is the molecular formula of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione?
The molecular formula of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione is C20H18O2.
What is the molecular weight of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione?
The molecular weight of 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione is 290.13 g/mol.
Where can I buy 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione?
You can request a quote for 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3,5,6-Tetramethyl-benzylidene)-indan-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.