1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-
TL;DR: 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- (CAS 41905-79-7) is a chemical compound with molecular formula C20H18O3 and molecular weight 306.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-oxo-2-(2,4,6-trimethylphenyl)inden-1-yl] acetate
Also Known As: 2-mesityl-1-oxo-1H-inden-3-yl acetate, 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-, 3-(Acetyloxy)-2-(2,4,6-trimethylphenyl)-1H-inden-1-one, [3-oxo-2-(2,4,6-trimethylphenyl)inden-1-yl] acetate, AM-814/41092312
| Molecular Formula | C20H18O3 |
|---|---|
| Molecular Weight | 306.13 g/mol |
| LogP | 4.23956 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.12558 |
| Heavy Atoms | 23 |
| Complexity | 849.2007 |
Chemical Identifiers
| CAS Number | 41905-79-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C2=C(C3=CC=CC=C3C2=O)OC(=O)C)C |
Product Overview
1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- (CAS 41905-79-7), with molecular formula C20H18O3 and molecular weight 306.13 g/mol. IUPAC: [3-oxo-2-(2,4,6-trimethylphenyl)inden-1-yl] acetate.
Chemical Property Profile of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-
Property Insights of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-
The XLogP value of 4.23956 indicates that 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- 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 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-?
The CAS number of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- is 41905-79-7.
What is the molecular formula of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-?
The molecular formula of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- is C20H18O3.
What is the molecular weight of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-?
The molecular weight of 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- is 306.13 g/mol.
Where can I buy 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-?
You can request a quote for 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Inden-1-one, 3-(acetyloxy)-2-(2,4,6-trimethylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.