3-(Pyrrol-1-yl)thiophene-2-methanol

C₉H₉NOSCAS 107073-27-8179.24 g/mol

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Properties

Molecular formula: C₉H₉NOS
Molar mass: 179.24 g/mol
Exact mass: 179.0405 Da
logP: 2.03Crippen estimate
Polar surface area: 25.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

107073-27-8

SMILES

C1=CN(C=C1)C2=C(SC=C2)CO

InChIKey

SMSUHWYHSLZKHS-UHFFFAOYSA-N

InChI

InChI=1S/C9H9NOS/c11-7-9-8(3-6-12-9)10-4-1-2-5-10/h1-6,11H,7H2

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Names and synonyms

1 names

[3-(1H-Pyrrol-1-yl)-2-thienyl]methanol

Work with 3-(Pyrrol-1-yl)thiophene-2-methanol

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

2-Thiophenemethanol636-72-636 % similar 1-(2-Aminophenyl)pyrrole6025-60-131 % similar 2-(1H-Pyrrol-1-yl)benzoic acid10333-68-330 % similar

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

Same formula

1-Ethoxy-2-isothiocyanatobenzene23163-84-0 5-Methoxy-2-methylbenzothiazole2941-69-7 6-Methoxy-2-methylbenzothiazole2941-72-2 1-Ethoxy-4-isothiocyanatobenzene3460-49-9 4-Methoxybenzyl isothiocyanate3694-57-3

Elsewhere

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