Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone
TL;DR: Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone (CAS 144538-04-5) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(2-methylpropyl)-1,4-dioxonaphthalen-2-yl] acetate
Also Known As: 3-Isobutyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate, q 53 2-acetoxy-3-isobutyl-1,4-naphthoquinone, [3-(2-methylpropyl)-1,4-dioxonaphthalen-2-yl] acetate, 3-isobutyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl acetate, 3-(2-methylpropyl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl acetate
Technical Specifications
| Molecular Formula | C16H16O4 |
| Molecular Weight | 272.10486 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.10486 Da |
| Heavy Atoms | 20 |
| Complexity | 473.0 |
| SMILES | CC(C)CC1=C(C(=O)C2=CC=CC=C2C1=O)OC(=O)C |
| InChIKey | SVQGABAJPMGSFZ-UHFFFAOYSA-N |
Chemical Property Profile of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone
Property Insights of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone
The XLogP value of 3.0 indicates that Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone. Following Lipinski's Rule of Five, Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone?
The CAS number of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone is 144538-04-5.
What is the molecular formula of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone?
The molecular formula of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone is C16H16O4.
What is the molecular weight of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone?
The molecular weight of Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone is 272.10486 g/mol.
Where can I buy Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone?
You can request a quote for Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone?
Yes, CoreyChem provides custom synthesis services for Q 53 2-Acetoxy-3-isobutyl-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.