2-(4-Bromophenyl)benzimidazole

CAS
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Purity
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CAS
2622-74-4
Size
---
Purity
>98.0%(T)(HPLC)
Price
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Availability
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Quantity
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Catalog Number

ACM2622744

Product Name

2-(4-Bromophenyl)benzimidazole

Structure

Structure

CAS

2622-74-4

Category

Other

IUPAC Name

2-(4-bromophenyl)-1H-benzimidazole

Molecular Weight

273.13

Molecular Formula

C13H9BrN2

Canonical SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H9BrN2/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H,(H,15,16)

InChI Key

YRWMGOSKROWAIT-UHFFFAOYSA-N

Melting Point

299 °C

Appearance

White to Brown powder to crystal

Complexity

238

Covalently-Bonded Unit Count

1

Exact Mass

271.99491g/mol

Formal Charge

0

H-Bond Acceptor

1

H-Bond Donor

1

Heavy Atom Count

16

Monoisotopic Mass

271.99491g/mol

NSC Number

144032

Rotatable Bond Count

1

XLogP3

3.9

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 2-(4-Bromophenyl)benzimidazole?

The molecular formula is C13H9BrN2.

What is the molecular weight of 2-(4-Bromophenyl)benzimidazole?

The molecular weight is 273.13 g/mol.

When was 2-(4-Bromophenyl)benzimidazole created and modified?

It was created on 2005-03-26 and last modified on 2023-12-02.

What is the IUPAC name of 2-(4-Bromophenyl)benzimidazole?

The IUPAC name is 2-(4-bromophenyl)-1H-benzimidazole.

What is the InChI of 2-(4-Bromophenyl)benzimidazole?

The InChI is InChI=1S/C13H9BrN2/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H,(H,15,16).

What is the InChIKey of 2-(4-Bromophenyl)benzimidazole?

The InChIKey is YRWMGOSKROWAIT-UHFFFAOYSA-N.

What is the Canonical SMILES of 2-(4-Bromophenyl)benzimidazole?

The Canonical SMILES is C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Br.

What is the CAS number of 2-(4-Bromophenyl)benzimidazole?

The CAS number is 2622-74-4.

What is the molecular weight of 2-(4-Bromophenyl)benzimidazole according to PubChem?

The molecular weight is 273.13 g/mol according to PubChem.

Is 2-(4-Bromophenyl)benzimidazole a canonicalized compound?

Yes, it is a canonicalized compound according to PubChem.

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