1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid | CAS No. 1640981-19-6

1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid

Basic Information

CAS Number

1640981-19-6

Molecular Formula

C16H14N2O3

Molecular Weight

282.3 g/mol

AD

Basic Physical Properties

CC1=NC2C(=CC(=CC=2O)C(O)=O)N1CC1C=CC=CC=1

InChI

InChI=1S/C16H14N2O3/c1-10-17-15-13(7-12(16(20)21)8-14(15)19)18(10)9-11-5-3-2-4-6-11/h2-8,19H,9H2,1H3,(H,20,21)

InChIKey

LRVLIEIZJOKBQA-UHFFFAOYSA-N

LogP

2.796820000000001

Topological Polar Surface Area

75.35000000000002 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

384

Synonyms & References

English

  • C(C1=CC=CC=C1)N1C(=NC2=C1C=C(C=C2O)C(=O)O)C
  • 1-benzyl-4-hydroxy-2-methyl-1H-benzo[d]imidazole-6-carboxylic acid

FAQ

What are the physical and chemical properties of 1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid (CAS: 1640981-19-6)?

1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid is a white to off-white crystalline solid with a molecular weight of approximately 332.3 g/mol. It has a high solubility in organic solvents like methanol and ethanol but is poorly soluble in water. The compound is moderately reactive, particularly towards nucleophiles and reducing agents. It exhibits good absorption properties, which is beneficial for its use in sensor applications.

How is 1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid (CAS: 1640981-19-6) typically synthesized?

1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid is typically synthesized via a multi-step process involving the condensation of 2-methylbenzimidazole with benzylic alcohol, followed by the introduction of a hydroxyl group via a nucleophilic substitution reaction. The process requires careful control of reaction conditions to achieve high yields and selectivity.

What industries use 1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid (CAS: 1640981-19-6)?

1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid is used in various industries, including pharmaceuticals for its antioxidant and anti-inflammatory properties, polymers for its use as a stabilizer, and sensors for its ability to act as a chromogenic reagent. It is also of interest in the semiconductor industry as a dopant.

What precautions should be taken when handling 1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid (CAS: 1640981-19-6)?

When handling 1-Benzyl-4-hydroxy-2-methyl-1H-benzimidazole-6-carboxylic acid, it is important to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. The compound should be used in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up immediately, and proper disposal procedures should be followed. Always consult the Safety Data Sheet (SDS) for detailed safety information.

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