3-[2-(Trimethylsilyl)ethynyl]thiophene

C₉H₁₂SSiCAS 130995-13-0180.34 g/mol

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Properties

Molecular formula: C₉H₁₂SSi
Molar mass: 180.34 g/mol
Exact mass: 180.0429 Da
logP: 2.98Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

130995-13-0

SMILES

C[Si](C)(C)C#Cc1ccsc1

InChIKey

XJUQFUWWPCIZRB-UHFFFAOYSA-N

InChI

InChI=1S/C9H12SSi/c1-11(2,3)7-5-9-4-6-10-8-9/h4,6,8H,1-3H3

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Names and synonyms

4 names

Thiophene, 3-[2-(trimethylsilyl)ethynyl]-
Silane, trimethyl(3-thienylethynyl)-
3-[(Trimethylsilyl)ethynyl]thiophene
Trimethyl(thien-3-ylethynyl)silane

Work with 3-[2-(Trimethylsilyl)ethynyl]thiophene

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

3-Thiophenecarbonitrile1641-09-443 % similar Bis(trimethylsilyl)acetylene14630-40-132 % similar 3-Methoxythiophene17573-92-130 % similar 3-Ethylthiophene1795-01-330 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook