80567-68-6

Basic information

• Product Name: 1H-Benzimidazole,2-(chloromethyl)-5-methyl-(9CI)
• Synonyms: 1H-Benzimidazole,2-(chloromethyl)-5-methyl-(9CI);2-(chloromethyl)-6-methyl-1H-benzimidazole;2-(chloromethyl)-6-methyl-1H-benzimidazole(SALTDATA: HCl)
• CAS NO: 80567-68-6
• Molecular Formula: C₉H₉ClN₂
• Molecular Weight: 180.637
• Product Categories: BENZIMIDAZOLE
• Mol File: 80567-68-6.mol
• Article Data: 7

Chemical Properties

• Melting Point: 121-123 °C
• Boiling Point: 381.1°Cat760mmHg
• Flash Point: 216.2°C
• Appearance: /
• Density: 1.298g/cm³
• Vapor Pressure: 1.14E-05mmHg at 25°C
• Refractive Index: 1.657
• PKA: 11.45±0.10(Predicted)
• CAS DataBase Reference: 1H-Benzimidazole,2-(chloromethyl)-5-methyl-(9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-Benzimidazole,2-(chloromethyl)-5-methyl-(9CI)(80567-68-6)
• EPA Substance Registry System: 1H-Benzimidazole,2-(chloromethyl)-5-methyl-(9CI)(80567-68-6)

Safety Data

• Hazardous Substances Data: 80567-68-6(Hazardous Substances Data)

Usage

General Description

1H-Benzimidazole, 2-(chloromethyl)-5-methyl-(9CI) is a chemical compound with the molecular formula C10H10ClN3. It is a benzimidazole derivative that contains a chloromethyl and methyl group. 1H-Benzimidazole,2-(chloromethyl)-5-methyl-(9CI) is used in organic synthesis and pharmaceutical research, as it has potential applications in the development of drug molecules. It may also be used as a building block in the synthesis of complex organic molecules. Additionally, it is essential to handle and store this chemical with appropriate safety measures, as it may pose health and environmental hazards if mishandled.

InChI:InChI=1/C9H9ClN2/c1-6-2-3-7-8(4-6)12-9(5-10)11-7/h2-4H,5H2,1H3,(H,11,12)

Upstream product

• 496-72-0 4-methyl-1,2-diaminobenzene 
• 79-11-8 chloroacetic acid 
• 36743-66-5 ethyl chloroacetimidate hydrochloride 
• 638-07-3 ethyl (2-chloroaceto)acetate 
• 20034-02-0 (5-methyl-1H-benzimidazole-2-yl)methanol 

Downstream Products

• 122501-13-7 4-(4-Chloro-phenyl)-6-methyl-1H-2-oxa-3,4a,9-triaza-fluorene 
• 122501-09-1 4-(4-Chloro-phenyl)-7-methyl-1H-2-oxa-3,4a,9-triaza-fluorene 
• 122500-94-1 7-methyl-4-phenyl-1H-<1,2,4>oxadiazino<4,5-a>benzimidazole 
• 122500-93-0 8-methyl-4-phenyl-1H-<1,2,4>xadiazino<4,5-a>benzimidazole 
• 122501-10-4 7-Methyl-4-(4-nitro-phenyl)-1H-2-oxa-3,4a,9-triaza-fluorene 
• 122501-14-8 6-Methyl-4-(4-nitro-phenyl)-1H-2-oxa-3,4a,9-triaza-fluorene 
• 1087608-09-0 N-[(5-methyl-1H-1,3-benzimidazol-2-yl)methyl]-N-propylamine 
• 946731-73-3 N-[(5-methyl-1H-1,3-benzimidazol-2-yl)methyl]-N-(4-methylphenyl)amine 
• 1244782-26-0 N-mesityl-N-[(5-methyl-1H-1,3-benzimidazol-2-yl)methyl]amine 
• 1244782-27-1 N-benzyl-N-[(5-methyl-1H-1,3-benzimidazol-2-yl)methyl]methanamine 
• 1343428-46-5 C₁₇H₁₇N₃S₂ 

Relevant articles and documents

Synthesis, characterization and antibacterial evaluation of some novel benzimidazole derivatives containing 1,3,4-thiadiazole moiety

A series of novel 5-amino-1,3,4-thiadiazole-2-thiol and 1,3,4-thiadiazole-2,5-dithiol derivatives of benzimidazole were synthesized through nucleophilic substitution reaction of 5-substituted-2-(chloromethyl)-1H-benzimidazole, structures of the synthesized compounds were proved by spectral methods of analysis (FT-IR, 1H and 13C NMR). All the target compounds were screened for their antibacterial activity toward gram-negative (E.coli, P. aeruginosa) and Gram-positive (B. subtilis, S. aureus) bacteria, most of the synthesized derivatives exhibited good to moderate activity toward both Gram-positive (B. subtilis, S. aureus) and Gram-negative (E.coli, P. aeruginosa) bacteria.

NOVEL BENZIMIDAZOLE BASED EGFR INHIBITORS

The present invention disclosed a novel EGFR inhibitor compound of formula (I), process for preparation thereof and methods of treating abnormal cell growth in mammals by administering the compounds of formula (I). Wherein, R= -H, 3-CH3, 4-NO2, 4-Cl, 2-CH3, 4-CH3, 4-Br, 4-F R1= -H, -4-OCH3, -4-NO2,-2-NO2, -4-Cl, -2,4,6-CH3, -4-CH3, -2-F,4-Br, -4-CF3, -4-S-CH3, -4-Cl,-3-CF3, -3-S-CH3, -3,5-CF3, -2-S-CH3, -3-CF3,-4-OCF3, -Si-(CH3)3, -Si-(C2H5)3, (CH3)2-Si- C2H5.

Condensation of Ortho-phenylenediamines and Phenylhydrazines with Ethyl 4-Chloro-3-oxobutanoate: A Facile Approach for the Synthesis of Substituted 1 H-Benzimidazoles, Pyrazolones, and Pyrazoles

Substituted 1H-benzimidazoles, pyrazolones, and pyrazoles have been synthesized by the condensation of ortho-phenylenediamines and phenylhydrazines, respectively, with ethyl 4-chloro-3-oxobutanoate in good yields. The present approach is novel, straightforward, and being reported for the first time with ethyl 4-chloro-3-oxobutanoate.