61273-95-8

Basic information

• Product Name: 1-benzyl-1,2,5,6-tetrahydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridinium hydrogen oxalate
• Synonyms: 1-benzyl-1,2,5,6-tetrahydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridinium hydrogen oxalate
• CAS NO: 61273-95-8
• Molecular Formula: C24H29NO5
• Molecular Weight: 411.49076
• EINECS: 262-683-3
• Mol File: 61273-95-8.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 437.9°Cat760mmHg
• Flash Point: 128.1°C
• Appearance: /
• Density: g/cm³
• Vapor Pressure: 7.22E-08mmHg at 25°C
• CAS DataBase Reference: 1-benzyl-1,2,5,6-tetrahydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridinium hydrogen oxalate(CAS DataBase Reference)
• NIST Chemistry Reference: 1-benzyl-1,2,5,6-tetrahydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridinium hydrogen oxalate(61273-95-8)
• EPA Substance Registry System: 1-benzyl-1,2,5,6-tetrahydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridinium hydrogen oxalate(61273-95-8)

Safety Data

• Hazardous Substances Data: 61273-95-8(Hazardous Substances Data)

Usage

Chemical Class

Pyridinium salts

Explanation

The compound belongs to the class of pyridinium salts, which are organic compounds containing a positively charged nitrogen atom.
2. Quaternary Ammonium Compound

Explanation

It is a quaternary ammonium compound, meaning it contains a positively charged nitrogen atom bonded to four organic groups.
3. Benzyl Group

Explanation

The chemical structure includes a benzyl group, which is a phenylmethyl group (C6H5-CH2-) attached to the molecule.
4. Methoxyphenylmethyl Group

Explanation

The compound also contains a methoxyphenylmethyl group, which is a phenylmethyl group with a methoxy (-OCH3) substituent.
5. Dimethylpyridinium Group

Explanation

The structure features a dimethylpyridinium group, which is a pyridine ring with two methyl (-CH3) substituents.
6. Tetrahydro-2 Backbone

Explanation

The compound has a tetrahydro-2 backbone, indicating that the pyridine ring is partially saturated with four hydrogen atoms.
7. Hydrogen Oxalate Group

Explanation

The compound contains a hydrogen oxalate group, which is a salt formed from the reaction of oxalic acid and hydrogen ions (H+).
8. Pharmaceutical Applications

Explanation

Due to its unique structure and properties, the compound may have potential applications in the pharmaceutical industry for drug development.
9. Chemical Industry Applications

Explanation

The compound's properties may also make it useful in the chemical industry for various purposes, such as synthesis or catalysis.
10. Research Applications

Explanation

The compound's unique structure could be valuable for research purposes, particularly in the study of organic chemistry and the development of new synthetic methods.

InChI:InChI=1/C22H27NO.C2H2O4/c1-17-13-14-23(16-20-7-5-4-6-8-20)22(18(17)2)15-19-9-11-21(24-3)12-10-19;3-1(4)2(5)6/h4-12,22H,13-16H2,1-3H3;(H,3,4)(H,5,6)