trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane

C14H20Si — CID 23390603

IUPACtrimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane
SMILESCC(C)c1ccc(C#C[Si](C)(C)C)cc1
InChIInChI=1S/C14H20Si/c1-12(2)14-8-6-13(7-9-14)10-11-15(3,4)5/h6-9,12H,1-5H3
InChIKeyXZUKJNDAVNPSDX-UHFFFAOYSA-N
MW216.40 g/mol
LogP4.04
Rot. Bonds1

About trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane

trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane (PubChem CID 23390603) has the molecular formula C14H20Si and a molecular weight of 216.40 g/mol. Its IUPAC name is trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane
PubChem CID23390603
Molecular FormulaC14H20Si
Molecular Weight216.40 g/mol
Exact Mass216.13
IUPAC Nametrimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane
SMILESCC(C)c1ccc(C#C[Si](C)(C)C)cc1
InChIInChI=1S/C14H20Si/c1-12(2)14-8-6-13(7-9-14)10-11-15(3,4)5/h6-9,12H,1-5H3
InChIKeyXZUKJNDAVNPSDX-UHFFFAOYSA-N
XLogP4.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 54.04
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'}

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Related Compounds

trimethyl-[2-[4-[2-[4-[2-[4-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]phenyl]ethynyl]phenyl]ethynyl]silane
CID 15312832
2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane
CID 71381536
4-(2-trimethylsilylethynyl)phenol
CID 10750210
trimethyl-[2-[4-[2-(4-methylphenyl)ethynyl]phenyl]ethynyl]silane
CID 66777028
ethane;(1S)-1-[4-(2-trimethylsilylethynyl)phenyl]propan-1-ol;zinc
CID 145453132
4-[2-[4-[2-[4-(2-trimethylsilylethynyl)phenyl]ethynyl]phenyl]ethynyl]phenol
CID 11843653
(2S)-N-ethyl-2-[4-(2-trimethylsilylethynyl)phenyl]propanamide
CID 124636916
2,3-dimethylbutane;ethane;1-propan-2-yl-4-prop-1-ynylbenzene
CID 144704481
trimethyl-[2-[4-[2-phenyl-3-(4-propan-2-ylphenyl)-1,3-dihydropyrazol-5-yl]phenyl]ethynyl]silane
CID 67498182
4-[4-(2-trimethylsilylethynyl)phenyl]benzonitrile
CID 69484722
CID 45276954
CID 45276954
trimethyl(2-naphthalen-2-ylethynyl)silane
CID 12579656

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane?
The IUPAC name of trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane (CID 23390603) is trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane.
What is the SMILES notation for trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane?
The canonical SMILES for trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane is CC(C)c1ccc(C#C[Si](C)(C)C)cc1.
What is the InChIKey of trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane?
The InChIKey is XZUKJNDAVNPSDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Si/c1-12(2)14-8-6-13(7-9-14)10-11-15(3,4)5/h6-9,12H,1-5H3.
What are the key properties of trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane?
trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane has a molecular weight of 216.40 g/mol, XLogP of 4.04, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(4-propan-2-ylphenyl)ethynyl]silane is sourced from PubChem (CID 23390603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).