2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal
TL;DR: 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal (CAS 14348-64-2) is a chemical compound with molecular formula C14H12O3 and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,4-dioxonaphthalen-2-yl)-2-methylpropanal
Also Known As: 2-(1,4-dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal, 1-Formylisopropyl-naphthochinon, 2-(1,4-dioxonaphthalen-2-yl)-2-methylpropanal, 2-(1,4-Dioxo-2-naphthyl)-2-methyl-propanal, 2-(1,4-dioxo(2-naphthyl))-2-methylpropanal
| Molecular Formula | C14H12O3 |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.07864 |
| Heavy Atoms | 17 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 14348-64-2 |
|---|---|
| SMILES | CC(C)(C=O)C1=CC(=O)C2=CC=CC=C2C1=O |
| InChIKey | RBXCNNSCGNJMLF-UHFFFAOYSA-N |
Product Overview
2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal (CAS 14348-64-2), with molecular formula C14H12O3 and molecular weight 228.08 g/mol. IUPAC: 2-(1,4-dioxonaphthalen-2-yl)-2-methylpropanal.
Chemical Property Profile of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal
Property Insights of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal. With a topological polar surface area (TPSA) of 51.2 Ų, 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal 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 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal?
The CAS number of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal is 14348-64-2.
What is the molecular formula of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal?
The molecular formula of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal is C14H12O3.
What is the molecular weight of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal?
The molecular weight of 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal is 228.08 g/mol.
Where can I buy 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal?
You can request a quote for 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,4-Dioxo-1,4-dihydronaphthalen-2-yl)-2-methylpropanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.