ethane;(4-ethynylphenyl)-dimethylsilane

C12H18Si — CID 123754833

IUPACethane;(4-ethynylphenyl)-dimethylsilane
SMILESC#Cc1ccc([SiH](C)C)cc1.CC
InChIInChI=1S/C10H12Si.C2H6/c1-4-9-5-7-10(8-6-9)11(2)3;1-2/h1,5-8,11H,2-3H3;1-2H3
InChIKeyQWVAYIQWHUTKEP-UHFFFAOYSA-N
MW190.36 g/mol
LogP2.39
Rot. Bonds1

About ethane;(4-ethynylphenyl)-dimethylsilane

ethane;(4-ethynylphenyl)-dimethylsilane (PubChem CID 123754833) has the molecular formula C12H18Si and a molecular weight of 190.36 g/mol. Its IUPAC name is ethane;(4-ethynylphenyl)-dimethylsilane.

Molecular Properties

Compound Nameethane;(4-ethynylphenyl)-dimethylsilane
PubChem CID123754833
Molecular FormulaC12H18Si
Molecular Weight190.36 g/mol
Exact Mass190.12
IUPAC Nameethane;(4-ethynylphenyl)-dimethylsilane
SMILESC#Cc1ccc([SiH](C)C)cc1.CC
InChIInChI=1S/C10H12Si.C2H6/c1-4-9-5-7-10(8-6-9)11(2)3;1-2/h1,5-8,11H,2-3H3;1-2H3
InChIKeyQWVAYIQWHUTKEP-UHFFFAOYSA-N
XLogP2.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 52.39
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

1-tert-butyl-4-ethynylbenzene;ethane
CID 143373231
1-ethynyl-4-(4-ethynylphenyl)benzene
CID 139087486
1-ethynyl-4-(1-fluoroethyl)benzene
CID 178189900
(4-ethynylphenyl)methoxy-dimethylsilane
CID 174611884
(1R,2R)-1,2-bis(4-ethynylphenyl)-N,N'-dimethylethane-1,2-diamine
CID 166838591
1,4-bis(ethynyl)benzene;bis(1-ethynyl-4-ethynylbenzene);bis(platinum(2+))
CID 177477100
1-ethynyl-4-methylbenzene;formaldehyde;methane
CID 143289915
(1,2-13C2)ethynylbenzene
CID 71309164
ethane;4-ethynyl-N-methylbenzamide
CID 178156727
(1S)-1-(4-ethynylphenyl)propan-1-amine
CID 131144563
1-butyl-4-ethynylbenzene;ethane
CID 144704471
dimethyl-[3-(4-methylphenyl)prop-2-ynyl]silane;1-ethynyl-4-methylbenzene
CID 159596917

Frequently Asked Questions

What is the IUPAC name of ethane;(4-ethynylphenyl)-dimethylsilane?
The IUPAC name of ethane;(4-ethynylphenyl)-dimethylsilane (CID 123754833) is ethane;(4-ethynylphenyl)-dimethylsilane.
What is the SMILES notation for ethane;(4-ethynylphenyl)-dimethylsilane?
The canonical SMILES for ethane;(4-ethynylphenyl)-dimethylsilane is C#Cc1ccc([SiH](C)C)cc1.CC.
What is the InChIKey of ethane;(4-ethynylphenyl)-dimethylsilane?
The InChIKey is QWVAYIQWHUTKEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Si.C2H6/c1-4-9-5-7-10(8-6-9)11(2)3;1-2/h1,5-8,11H,2-3H3;1-2H3.
What are the key properties of ethane;(4-ethynylphenyl)-dimethylsilane?
ethane;(4-ethynylphenyl)-dimethylsilane has a molecular weight of 190.36 g/mol, XLogP of 2.39, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4-ethynylphenyl)-dimethylsilane is sourced from PubChem (CID 123754833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).