1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-
TL;DR: 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- (CAS 87698-35-9) is a chemical compound with molecular formula C15H15NO5 and molecular weight 289.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-ethoxy-2-methylprop-2-enyl)-2-nitroindene-1,3-dione
Also Known As: 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-, 2-(3-ethoxy-2-methylprop-2-enyl)-2-nitroindene-1,3-dione, 2-(3-ethoxy-2-methylprop-2-en-1-yl)-2-nitro-1H-indene-1,3(2H)-dione
| Molecular Formula | C15H15NO5 |
|---|---|
| Molecular Weight | 289.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 89.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.09503 |
| Heavy Atoms | 21 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 87698-35-9 |
|---|---|
| SMILES | CCOC=C(C)CC1(C(=O)C2=CC=CC=C2C1=O)[N+](=O)[O-] |
| InChIKey | JXLWJLMJUDPALC-UHFFFAOYSA-N |
Product Overview
1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- (CAS 87698-35-9), with molecular formula C15H15NO5 and molecular weight 289.10 g/mol. IUPAC: 2-(3-ethoxy-2-methylprop-2-enyl)-2-nitroindene-1,3-dione.
Chemical Property Profile of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-
Property Insights of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-
The XLogP value of 3.0 indicates that 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-. Following Lipinski's Rule of Five, 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- has 0 hydrogen bond donor(s) and 5 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-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-?
The CAS number of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- is 87698-35-9.
What is the molecular formula of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-?
The molecular formula of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- is C15H15NO5.
What is the molecular weight of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-?
The molecular weight of 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- is 289.10 g/mol.
Where can I buy 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-?
You can request a quote for 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indene-1,3(2H)-dione, 2-(3-ethoxy-2-methyl-2-propenyl)-2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.