2-(3,4-difluorophenyl)-2H-imidazole

C9H6F2N2 — CID 68557525

IUPAC2-(3,4-difluorophenyl)-2H-imidazole
SMILESFc1ccc(C2N=CC=N2)cc1F
InChIInChI=1S/C9H6F2N2/c10-7-2-1-6(5-8(7)11)9-12-3-4-13-9/h1-5,9H
InChIKeyZUWJBYANVJGRGL-UHFFFAOYSA-N
MW180.16 g/mol
LogP2.12
Rot. Bonds1

About 2-(3,4-difluorophenyl)-2H-imidazole

2-(3,4-difluorophenyl)-2H-imidazole (PubChem CID 68557525) has the molecular formula C9H6F2N2 and a molecular weight of 180.16 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-2H-imidazole.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-2H-imidazole
PubChem CID68557525
Molecular FormulaC9H6F2N2
Molecular Weight180.16 g/mol
Exact Mass180.05
IUPAC Name2-(3,4-difluorophenyl)-2H-imidazole
SMILESFc1ccc(C2N=CC=N2)cc1F
InChIInChI=1S/C9H6F2N2/c10-7-2-1-6(5-8(7)11)9-12-3-4-13-9/h1-5,9H
InChIKeyZUWJBYANVJGRGL-UHFFFAOYSA-N
XLogP2.12
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.16
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-2H-imidazole?
The IUPAC name of 2-(3,4-difluorophenyl)-2H-imidazole (CID 68557525) is 2-(3,4-difluorophenyl)-2H-imidazole.
What is the SMILES notation for 2-(3,4-difluorophenyl)-2H-imidazole?
The canonical SMILES for 2-(3,4-difluorophenyl)-2H-imidazole is Fc1ccc(C2N=CC=N2)cc1F.
What is the InChIKey of 2-(3,4-difluorophenyl)-2H-imidazole?
The InChIKey is ZUWJBYANVJGRGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F2N2/c10-7-2-1-6(5-8(7)11)9-12-3-4-13-9/h1-5,9H.
What are the key properties of 2-(3,4-difluorophenyl)-2H-imidazole?
2-(3,4-difluorophenyl)-2H-imidazole has a molecular weight of 180.16 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-2H-imidazole is sourced from PubChem (CID 68557525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).