5-Bromo-2-methylbenzimidazole

• CAS: 1964-77-8
• Catalog Number: ACM1964778
• Category: Other
• Molecular Weight: 211.06
• Molecular Formula: C8H7BrN2

Custom Q&A

What is the molecular formula of 5-Bromo-2-methylbenzimidazole?

The molecular formula is C8H7BrN2.

What is the molecular weight of 5-Bromo-2-methylbenzimidazole?

The molecular weight is 211.06 g/mol.

What is the IUPAC name of 5-Bromo-2-methylbenzimidazole?

The IUPAC name is 6-bromo-2-methyl-1H-benzimidazole.

What is the InChI of 5-Bromo-2-methylbenzimidazole?

The InChI is InChI=1S/C8H7BrN2/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3,(H,10,11).

What is the InChIKey of 5-Bromo-2-methylbenzimidazole?

The InChIKey is FHDFUQGJYYGLHJ-UHFFFAOYSA-N.

What is the Canonical SMILES of 5-Bromo-2-methylbenzimidazole?

The Canonical SMILES is CC1=NC2=C(N1)C=C(C=C2)Br.

What is the CAS number of 5-Bromo-2-methylbenzimidazole?

The CAS number is 1964-77-8.

What is the European Community (EC) number of 5-Bromo-2-methylbenzimidazole?

The European Community (EC) number is 801-805-7.

What is the DSSTox Substance ID of 5-Bromo-2-methylbenzimidazole?

The DSSTox Substance ID is DTXSID10346289.

Is the compound canonicalized?

Yes, the compound is canonicalized according to PubChem.

Synthetic Use

Upstream Synthesis Route 1

• 78-39-7
• 1575-37-7

• 1964-77-8

Reference: [1] European Journal of Medicinal Chemistry, 2015, vol. 90, p. 241 - 250

Upstream Synthesis Route 2

• 78191-00-1
• 1575-37-7

• 1964-77-8

Reference: [1] Tetrahedron Letters, 2013, vol. 54, # 21, p. 2693 - 2695

Upstream Synthesis Route 3

• 1445-45-0
• 875-51-4

• 1964-77-8

Reference: [1] Tetrahedron, 2011, vol. 67, # 41, p. 8027 - 8033

Upstream Synthesis Route 4

• 881-50-5

• 1964-77-8

Reference: [1]Chemische Berichte,1874,vol. 7,p. 348

Upstream Synthesis Route 5

• 108-24-7
• 1575-37-7

• 1964-77-8

Reference: [1]Journal of the Chemical Society,1931,p. 1143,1153