2,5-Dimethylpyrrole

C₆H₉NCAS 625-84-395.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₉N
Molar mass: 95.15 g/mol
Exact mass: 95.0735 Da
Density: 0.9281 g/mL (at 20 °C)
Melting point: 7.7 °C
Boiling point: 171 °C
logP: 1.63Crippen estimate
Polar surface area: 15.8 Å²
H-bond donors / acceptors: 1 / 0
Rotatable bonds: 0

Identifiers

CAS number

625-84-3

SMILES

Cc1ccc(C)[nH]1

InChIKey

PAPNRQCYSFBWDI-UHFFFAOYSA-N

InChI

InChI=1S/C6H9N/c1-5-3-4-6(2)7-5/h3-4,7H,1-2H3

Weigh it out

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

Names and synonyms

4 names

1H-Pyrrole, 2,5-dimethyl-
Pyrrole, 2,5-dimethyl-
2,5-Dimethyl-1H-pyrrole
NSC 4507

Reactions

2,5-DIMETHYLPYRROLE (Pyrrole, 2,5-dimethyl-)product

Work with 2,5-Dimethylpyrrole

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,6-Dimethyl-4-pyridinol13603-44-645 % similar 2,6-Dimethyl-4-pyridinamine3512-80-945 % similar 2-Methylindole95-20-538 % similar Ethyl 5-methylpyrrole-2-carboxylate3284-51-337 % similar 2,4-Dimethylimidazole930-62-136 % similar 2,5-Dimethylindole1196-79-835 % similar 2-Phenyl-4-methylimidazole827-43-035 % similar 1,3-Dihydro-4-methyl-2H-imidazol-2-one1192-34-333 % similar

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

Same formula

Cyclopentanecarbonitrile4254-02-8 2,2-Dimethylcyclopropanecarbonitrile5722-11-2 1-Ethyl-1H-pyrrole617-92-5 2,4-Dimethylpyrrole625-82-1

Elsewhere

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