42711-76-2

Basic information

• Product Name: 3-nitroadamantane-1-carboxylic acid
• Synonyms: 3-nitroadamantane-1-carboxylic acid;1-Nitro-3-adamantanecarboxylic acid
• CAS NO: 42711-76-2
• Molecular Formula: C11H15NO4
• Molecular Weight: 225.24
• Mol File: 42711-76-2.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 394°C at 760 mmHg
• Flash Point: 171.2°C
• Appearance: /
• Density: 1.38g/cm³
• Vapor Pressure: 2.63E-07mmHg at 25°C
• Refractive Index: 1.583
• CAS DataBase Reference: 3-nitroadamantane-1-carboxylic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 3-nitroadamantane-1-carboxylic acid(42711-76-2)
• EPA Substance Registry System: 3-nitroadamantane-1-carboxylic acid(42711-76-2)

Safety Data

• Hazardous Substances Data: 42711-76-2(Hazardous Substances Data)

Usage

InChI:InChI=1/C11H15NO4/c13-9(14)10-2-7-1-8(3-10)5-11(4-7,6-10)12(15)16/h7-8H,1-6H2,(H,13,14)

Upstream product

• 828-51-3 1-Adamantanecarboxylic acid 
• 524-38-9 N-hydroxyphthalimide 

Relevant articles and documents

NITRATION OR CARBOXYLATION CATALYSTS

In the presence of an imide compound (e.g., N-hydroxyphthalimide) shown by the following formula (1): ???wherein R1and R2represent a hydrogen atom, a halogen atom, an alkyl group, an aryl group and a cycloalkyl group, and R1and R2may bond together to form a double bond, or an aromatic or non-aromatic ring, and Y is an O or OH, and n denotes 1 to 3;, a substrate is allowed to contact with at least one reactant selected from (i) a nitrogen oxide and (ii) a mixture of carbon monoxide and oxygen to be introduced with at least one functional group selected from a nitro group and a carboxyl group. The nitrogen oxide includes, for example, a compound represented by the formula NxOy(e.g., N2O3, NO2). The substrate includes, for example, a compound having a methine carbon atom (e.g., adamantane), a compound having a methyl group or a methylene group at an adjacent moiety of an aromatic ring. According to such reaction, the substrate can be efficiently nitrated or carboxylated even in a mild or moderate condition.