1H-Indene-1,3(2H)-dione, 2-nitroso-
TL;DR: 1H-Indene-1,3(2H)-dione, 2-nitroso- (CAS 20854-76-6) is a chemical compound with molecular formula C9H5NO3 and molecular weight 175.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrosoindene-1,3-dione
Also Known As: 2-Nitroso-1,3-indandione, 2-Nitroso-1H-indene-1,3(2H)-dione, 2-nitrosoindene-1,3-dione, 1H-Indene-1,3(2H)-dione, 2-nitroso-, 1H-Indene-1,3(2H)-dione,2-nitroso-
| Molecular Formula | C9H5NO3 |
|---|---|
| Molecular Weight | 175.03 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.02695 |
| Heavy Atoms | 13 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 20854-76-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(C2=O)N=O |
| InChIKey | ZQQVLLUALVAKKD-UHFFFAOYSA-N |
Product Overview
1H-Indene-1,3(2H)-dione, 2-nitroso- (CAS 20854-76-6), with molecular formula C9H5NO3 and molecular weight 175.03 g/mol. IUPAC: 2-nitrosoindene-1,3-dione.
Chemical Property Profile of 1H-Indene-1,3(2H)-dione, 2-nitroso-
Property Insights of 1H-Indene-1,3(2H)-dione, 2-nitroso-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indene-1,3(2H)-dione, 2-nitroso-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indene-1,3(2H)-dione, 2-nitroso-. Following Lipinski's Rule of Five, 1H-Indene-1,3(2H)-dione, 2-nitroso- 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
Frequently Asked Questions
What is the CAS number of 1H-Indene-1,3(2H)-dione, 2-nitroso-?
The CAS number of 1H-Indene-1,3(2H)-dione, 2-nitroso- is 20854-76-6.
What is the molecular formula of 1H-Indene-1,3(2H)-dione, 2-nitroso-?
The molecular formula of 1H-Indene-1,3(2H)-dione, 2-nitroso- is C9H5NO3.
What is the molecular weight of 1H-Indene-1,3(2H)-dione, 2-nitroso-?
The molecular weight of 1H-Indene-1,3(2H)-dione, 2-nitroso- is 175.03 g/mol.
Where can I buy 1H-Indene-1,3(2H)-dione, 2-nitroso-?
You can request a quote for 1H-Indene-1,3(2H)-dione, 2-nitroso- 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-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indene-1,3(2H)-dione, 2-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.