(1,2-13C2)ethynyl(trimethyl)silane

C5H10Si — CID 66552881

IUPAC(1,2-13C2)ethynyl(trimethyl)silane
SMILESC[Si](C)(C)[13C]#[13CH]
InChIInChI=1S/C5H10Si/c1-5-6(2,3)4/h1H,2-4H3/i1+1,5+1
InChIKeyCWMFRHBXRUITQE-AEGZSVGQSA-N
MW100.21 g/mol
LogP1.50
Rot. Bonds

About (1,2-13C2)ethynyl(trimethyl)silane

(1,2-13C2)ethynyl(trimethyl)silane (PubChem CID 66552881) has the molecular formula C5H10Si and a molecular weight of 100.21 g/mol. Its IUPAC name is (1,2-13C2)ethynyl(trimethyl)silane.

Molecular Properties

Compound Name(1,2-13C2)ethynyl(trimethyl)silane
PubChem CID66552881
Molecular FormulaC5H10Si
Molecular Weight100.21 g/mol
Exact Mass100.06
IUPAC Name(1,2-13C2)ethynyl(trimethyl)silane
SMILESC[Si](C)(C)[13C]#[13CH]
InChIInChI=1S/C5H10Si/c1-5-6(2,3)4/h1H,2-4H3/i1+1,5+1
InChIKeyCWMFRHBXRUITQE-AEGZSVGQSA-N
XLogP1.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.21
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (1,2-13C2)ethynyl(trimethyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1,2-13C2)ethynyl(trimethyl)silane?
The IUPAC name of (1,2-13C2)ethynyl(trimethyl)silane (CID 66552881) is (1,2-13C2)ethynyl(trimethyl)silane.
What is the SMILES notation for (1,2-13C2)ethynyl(trimethyl)silane?
The canonical SMILES for (1,2-13C2)ethynyl(trimethyl)silane is C[Si](C)(C)[13C]#[13CH].
What is the InChIKey of (1,2-13C2)ethynyl(trimethyl)silane?
The InChIKey is CWMFRHBXRUITQE-AEGZSVGQSA-N. The full InChI is InChI=1S/C5H10Si/c1-5-6(2,3)4/h1H,2-4H3/i1+1,5+1.
What are the key properties of (1,2-13C2)ethynyl(trimethyl)silane?
(1,2-13C2)ethynyl(trimethyl)silane has a molecular weight of 100.21 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-13C2)ethynyl(trimethyl)silane is sourced from PubChem (CID 66552881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).