3-(Trimethylsilylethynyl)pyridine

C₁₀H₁₃NSiCAS 80673-00-3175.31 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₃NSi
Molar mass: 175.31 g/mol
Exact mass: 175.0817 Da
logP: 2.31Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.5% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

80673-00-3

SMILES

C[Si](C)(C)C#CC1=CN=CC=C1

InChIKey

MTMBLPOPETZZRX-UHFFFAOYSA-N

InChI

InChI=1S/C10H13NSi/c1-12(2,3)8-6-10-5-4-7-11-9-10/h4-5,7,9H,1-3H3

Weigh it out

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

Work with 3-(Trimethylsilylethynyl)pyridine

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

1-Phenyl-2-(trimethylsilyl)acetylene2170-06-159 % similar 1,3-Bis[(trimethylsilyl)ethynyl]benzene38170-80-857 % similar 1,4-Bis[(trimethylsilyl)ethynyl]benzene17938-13-554 % similar Nicotinonitrile100-54-947 % similar 3-Ethynylpyridine2510-23-847 % similar (4-Bromophenylethynyl)trimethylsilane16116-78-244 % similar 3-[2-(Trimethylsilyl)ethynyl]thiophene130995-13-043 % similar 4-(Trimethylsilyl)ethynylbenzaldehyde77123-57-041 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook