N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide | CAS No. 90823-38-4

N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide

Basic Information

CAS Number

90823-38-4

Molecular Formula

C28H33N3O4S

Molecular Weight

507.64 g/mol

AD

Basic Physical Properties

Melting Point

178-183°C

CC[N+](CC)(Cc1ccccc1)CC(=O)Nc2c(cccc2C)C.c1ccc2c(c1)C(=O)[N-]S2(=O)=O

InChI

InChI=1S/C21H28N2O.C7H5NO3S/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;9-7-5-3-1-2-4-6(5)12(10,11)8-7/h7-14H,5-6,15-16H2,1-4H3;1-4H,(H,8,9)

InChIKey

AOVWCKBXCSVODH-UHFFFAOYSA-N

LogP

5.68580

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Stability

Stable. Incompatible with strong oxidizing agents.

Synonyms & References

English

  • denatonium saccharide
  • Benzenemethanaminium, N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-, saccharide
  • Benzyldiethyl((2,6-xylylcarbamoyl)methyl)ammonium saccharide
  • RO-PEL
  • DENATONIUM SACHARIDE
  • benzyldiethyl
  • Denatoniumbenzoatesaccharide
  • Lignocaine benzyl saccharide
  • Benzyldiethyl-[(2,6-xylylcarbamoyl)methyl]-ammonium saccharide
  • N-(2-((2,6-Dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-benzenemethanaminium saccharide
  • 1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, ion(1-), N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethylbenzenemethanaminium (9CI)
  • Amerex
  • Denatonium saccharide
  • Denatonium saccharinate
  • Ro-Pel
  • Super Vilex

MDL Number

MFCD00214097

FAQ

What is N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4)?

N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4) is a complex organic compound with potential use in pharmaceutical applications. It contains benzyl, amino, and benzothiazole functional groups, and is a 1,1-dioxide derivative.

What are the main uses of N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4)?

N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4) is primarily used in pharmaceutical research for drug development and in analytical chemistry for reagents and standards.

Is N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4) safe?

N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4) should be handled with caution due to its chemical complexity. Proper personal protective equipment (PPE) should be worn, and it should be stored in a secure, well-ventilated area, away from flammable materials and direct sunlight.

How should N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4) be stored?

N-Benzyl-2-[(2,6-dimethylphenyl)amino]-N,N-diethyl-2-oxoethanaminium 3-oxo-3H-1,2-benzothiazol-2-ide 1,1-dioxide (CAS: 90823-38-4) should be stored in a cool, dry place, away from moisture, heat, and light. It should be kept in a tightly sealed container to prevent degradation. Ensure proper ventilation to avoid inhalation exposure.

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