5-Aminobenzimidazole

C₇H₇N₃CAS 934-22-5133.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₇N₃
Molar mass: 133.15 g/mol
Exact mass: 133.0640 Da
Melting point: 108–109 °C
Boiling point: 222 °C (at 3.5 Torr)
logP: 1.15Crippen estimate
Polar surface area: 54.7 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Identifiers

CAS number

934-22-5

SMILES

Nc1ccc2nc[nH]c2c1

InChIKey

WFRXSXUDWCVSPI-UHFFFAOYSA-N

InChI

InChI=1S/C7H7N3/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,8H2,(H,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names

1H-Benzimidazol-6-amine
Benzimidazole, 5-amino-
1H-Benzimidazol-5-amine
Benzimidazole, 5(or 6)-amino-
6-Aminobenzimidazole
NSC 231612
1H-Benzimidazol-5-ylamine
3H-Benzo[d]imidazol-5-amine
Benzimidazol-5-amine
1H-Benzoimidazol-5-ylamine
1H-1,3-Benzodiazol-6-amine
1H-1,3-Benzodiazol-5-amine

Work with 5-Aminobenzimidazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Chlorobenzimidazole4887-82-555 % similar 5-Methylbenzimidazole614-97-155 % similar 5-(Hydroxymethyl)-1H-benzimidazole106429-29-250 % similar 5-Methoxybenzimidazole4887-80-350 % similar 1H-Benzimidazole-6-carboxaldehyde58442-17-450 % similar 1H-Benzimidazole-5-carboxylic acid15788-16-646 % similar 5-Nitrobenzimidazole94-52-046 % similar 5-Amino-2-mercaptobenzimidazole2818-66-846 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1H-Pyrrolo[2,3-B]pyridin-5-ylamine100960-07-4 1H-Pyrazolo[3,4-B]pyridine,3-methyl-(9ci)116834-96-9 1-Methylbenzotriazole13351-73-0 5-Methylbenzotriazole136-85-6 2,5-Diaminobenzonitrile14346-13-5 3,4-Diaminobenzonitrile17626-40-3 1H-Indazol-5-amine19335-11-6 1H-Indazol-7-amine21443-96-9

Elsewhere

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