4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole

• CAS: 175135-14-5
• Catalog Number: ACM175135145
• Category: Bromine Series
• Molecular Weight: 265.03
• Molecular Formula: C₈H₄BrF₃N₂
• Synonyms: 175135-14-5, 4-Bromo-6-(trifluoromethyl)-1h-benzo[d]imidazole, 4-BROMO-6-(TRIFLUOROMETHYL)BENZIMIDAZOLE, 4-bromo-6-(trifluoromethyl)-1H-benzimidazole, ZINC00090522, PubChem6508, AC1MC5KC, SureCN761676, SureCN2298425, CTK4D5176, CTK5I6329, MolPort-000-141-669, ANW-55510, SBB102868, AKOS015835397, AKOS015911620, AG-C-02331, AG-E-24750, AG-G-99347, RP06394
• IUPAC Name: 4-bromo-6-(trifluoromethyl)-1H-benzimidazole
• Canonical SMILES: C1=C(C=C(C2=C1NC=N2)Br)C(F)(F)F
• InChI Key: HYTQERQCUFICAX-UHFFFAOYSA-N
• Boiling Point: 462.6ºC at 760 mmHg
• Melting Point: 216-218ºC
• Flash Point: 233.6ºC
• Density: 1.686g/cm³
• Exact Mass: 263.95100
• Hazard Statements: Xi,Xn
• H-Bond Acceptor: 4
• H-Bond Donor: 1
• Safety Description: 26-36/37/39

Custom Q&A

What is the molecular formula of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The molecular formula is C8H4BrF3N2.

What is the computed molecular weight of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The computed molecular weight is 265.03 g/mol.

When was 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole created in PubChem?

It was created on July 19, 2005.

When was 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole last modified in PubChem?

It was last modified on December 2, 2023.

What is the IUPAC name of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The IUPAC name is 4-bromo-6-(trifluoromethyl)-1H-benzimidazole.

What is the InChI of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The InChI is InChI=1S/C8H4BrF3N2/c9-5-1-4(8(10,11)12)2-6-7(5)14-3-13-6/h1-3H,(H,13,14).

What is the InChIKey of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The InChIKey is HYTQERQCUFICAX-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The canonical SMILES is C1=C(C=C(C2=C1NC=N2)Br)C(F)(F)F.

What is the CAS number of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The CAS number is 175135-14-5.

What is the XLogP3-AA value of 4-Bromo-6-(trifluoromethyl)-1H-benzo[d]imidazole?

The XLogP3-AA value is 3.1.