2-bromo-5-(2-bromophenyl)-1H-imidazole

C9H6Br2N2 — CID 117259929

IUPAC2-bromo-5-(2-bromophenyl)-1H-imidazole
SMILESBrc1ncc(-c2ccccc2Br)[nH]1
InChIInChI=1S/C9H6Br2N2/c10-7-4-2-1-3-6(7)8-5-12-9(11)13-8/h1-5H,(H,12,13)
InChIKeyKWJMKHRZJZCBIW-UHFFFAOYSA-N
MW301.97 g/mol
LogP3.60
Rot. Bonds1

About 2-bromo-5-(2-bromophenyl)-1H-imidazole

2-bromo-5-(2-bromophenyl)-1H-imidazole (PubChem CID 117259929) has the molecular formula C9H6Br2N2 and a molecular weight of 301.97 g/mol. Its IUPAC name is 2-bromo-5-(2-bromophenyl)-1H-imidazole.

Molecular Properties

Compound Name2-bromo-5-(2-bromophenyl)-1H-imidazole
PubChem CID117259929
Molecular FormulaC9H6Br2N2
Molecular Weight301.97 g/mol
Exact Mass299.89
IUPAC Name2-bromo-5-(2-bromophenyl)-1H-imidazole
SMILESBrc1ncc(-c2ccccc2Br)[nH]1
InChIInChI=1S/C9H6Br2N2/c10-7-4-2-1-3-6(7)8-5-12-9(11)13-8/h1-5H,(H,12,13)
InChIKeyKWJMKHRZJZCBIW-UHFFFAOYSA-N
XLogP3.60
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.97
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(2-bromophenyl)-1H-imidazole?
The IUPAC name of 2-bromo-5-(2-bromophenyl)-1H-imidazole (CID 117259929) is 2-bromo-5-(2-bromophenyl)-1H-imidazole.
What is the SMILES notation for 2-bromo-5-(2-bromophenyl)-1H-imidazole?
The canonical SMILES for 2-bromo-5-(2-bromophenyl)-1H-imidazole is Brc1ncc(-c2ccccc2Br)[nH]1.
What is the InChIKey of 2-bromo-5-(2-bromophenyl)-1H-imidazole?
The InChIKey is KWJMKHRZJZCBIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6Br2N2/c10-7-4-2-1-3-6(7)8-5-12-9(11)13-8/h1-5H,(H,12,13).
What are the key properties of 2-bromo-5-(2-bromophenyl)-1H-imidazole?
2-bromo-5-(2-bromophenyl)-1H-imidazole has a molecular weight of 301.97 g/mol, XLogP of 3.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(2-bromophenyl)-1H-imidazole is sourced from PubChem (CID 117259929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).