2-Bromo-1-methyl-1H-imidazole

• CAS: 16681-59-7
• Catalog Number: ACM16681597
• Category: Bromine Series
• Molecular Weight: 160.99
• Molecular Formula: C₄H₅BrN₂
• Synonyms: 639850_ALDRICH, 2-Bromo-1-methyl-1H-imidazole, ZINC02577853, CID2773262, 16681-59-7
• IUPAC Name: 2-bromo-1-methylimidazole
• SMILES: CN1C=CN=C1Br
• InChI Key: BANOTGHIHYMTDL-UHFFFAOYSA-N
• Boiling Point: 172ºC
• Flash Point: 110ºC
• Density: 1.649
• Exact Mass: 159.96400
• Hazard Statements: Xn:Harmful
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Safety Description: S26
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 2-Bromo-1-methyl-1H-imidazole?

The molecular formula of 2-Bromo-1-methyl-1H-imidazole is C4H5BrN2.

What is the molecular weight of 2-Bromo-1-methyl-1H-imidazole?

The molecular weight of 2-Bromo-1-methyl-1H-imidazole is 161.00 g/mol.

What is the IUPAC name of 2-Bromo-1-methyl-1H-imidazole?

The IUPAC name of 2-Bromo-1-methyl-1H-imidazole is 2-bromo-1-methylimidazole.

What is the InChI of 2-Bromo-1-methyl-1H-imidazole?

The InChI of 2-Bromo-1-methyl-1H-imidazole is InChI=1S/C4H5BrN2/c1-7-3-2-6-4(7)5/h2-3H,1H3.

What is the InChIKey of 2-Bromo-1-methyl-1H-imidazole?

The InChIKey of 2-Bromo-1-methyl-1H-imidazole is BANOTGHIHYMTDL-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Bromo-1-methyl-1H-imidazole?

The canonical SMILES of 2-Bromo-1-methyl-1H-imidazole is CN1C=CN=C1Br.

What is the CAS number of 2-Bromo-1-methyl-1H-imidazole?

The CAS number of 2-Bromo-1-methyl-1H-imidazole is 16681-59-7.

How many hydrogen bond donor counts does 2-Bromo-1-methyl-1H-imidazole have?

2-Bromo-1-methyl-1H-imidazole has zero hydrogen bond donors.

How many hydrogen bond acceptor counts does 2-Bromo-1-methyl-1H-imidazole have?

2-Bromo-1-methyl-1H-imidazole has one hydrogen bond acceptor.

How many rotatable bond counts does 2-Bromo-1-methyl-1H-imidazole have?

2-Bromo-1-methyl-1H-imidazole has zero rotatable bonds.