Molecule ID: 5798

IUPAC Name: 1H-benzimidazole

Description: The molecule is the 1H-tautomer of benzimidazole. It is a benzimidazole and a polycyclic heteroarene. It is a conjugate acid of a benzimidazolide. It is a tautomer of a 4H-benzimidazole, a 2H-benzimidazole and a 3aH-benzimidazole.

SMILES: c1ccc2[nH]cnc2c1

SELFIES: [C][=C][C][=C][NH1][C][=N][C][Ring1][Branch1][=C][Ring1][=Branch2]

InChI: InChI=1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9)

Molecular Properties:
- Polar Surface Area: 28.7 Ų
- LogP: 1.3