lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane

C12H21LiSi — CID 166444731

IUPAClithium 3-cyclohexylprop-1-ynyl(trimethyl)silane
SMILESC[Si](C)(C)C#C[CH-]C1CCCCC1.[Li+]
InChIInChI=1S/C12H21Si.Li/c1-13(2,3)11-7-10-12-8-5-4-6-9-12;/h10,12H,4-6,8-9H2,1-3H3;/q-1;+1
InChIKeyGJRSYLUNZYVWLQ-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.66
Rot. Bonds1

About lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane

lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane (PubChem CID 166444731) has the molecular formula C12H21LiSi and a molecular weight of 200.33 g/mol. Its IUPAC name is lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Namelithium 3-cyclohexylprop-1-ynyl(trimethyl)silane
PubChem CID166444731
Molecular FormulaC12H21LiSi
Molecular Weight200.33 g/mol
Exact Mass200.16
IUPAC Namelithium 3-cyclohexylprop-1-ynyl(trimethyl)silane
SMILESC[Si](C)(C)C#C[CH-]C1CCCCC1.[Li+]
InChIInChI=1S/C12H21Si.Li/c1-13(2,3)11-7-10-12-8-5-4-6-9-12;/h10,12H,4-6,8-9H2,1-3H3;/q-1;+1
InChIKeyGJRSYLUNZYVWLQ-UHFFFAOYSA-N
XLogP0.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-dicyclohexylboranylethynyl(trimethyl)silane
CID 22173041
1-cyclohexyl-3-trimethylsilylprop-2-yn-1-one
CID 11020104
cobalt;cyclooctane;cyclooctyl(trimethyl)silane
CID 57373058
bromo-cyclohexyl-dimethylsilane
CID 140692715
(1R)-1-[(2R,5R)-5-cyclohexyloxolan-2-yl]-3-trimethylsilylprop-2-yn-1-ol
CID 11414832
N-trimethylsilylcyclohexanamine
CID 521683
trans-(1R,2R)-2-(2-trimethylsilylethynyl)cyclohexane-1-carbaldehyde
CID 101130734
(3-cyclohexyl-3-prop-2-enoxyprop-1-ynyl)-trimethylsilane
CID 11207460
5-cyclopropylpent-1-ynyl(trimethyl)silane
CID 100968595
(1R)-2-(2-trimethylsilylethynyl)cyclopentan-1-ol
CID 59467082
(1S)-3-[tert-butyl(dimethyl)silyl]-1-cyclohexylprop-2-yn-1-ol
CID 124629082
tricyclohexyl(trimethylsilyl)silane
CID 139629055

Frequently Asked Questions

What is the IUPAC name of lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane?
The IUPAC name of lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane (CID 166444731) is lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane.
What is the SMILES notation for lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane?
The canonical SMILES for lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane is C[Si](C)(C)C#C[CH-]C1CCCCC1.[Li+].
What is the InChIKey of lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane?
The InChIKey is GJRSYLUNZYVWLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21Si.Li/c1-13(2,3)11-7-10-12-8-5-4-6-9-12;/h10,12H,4-6,8-9H2,1-3H3;/q-1;+1.
What are the key properties of lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane?
lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane has a molecular weight of 200.33 g/mol, XLogP of 0.66, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 3-cyclohexylprop-1-ynyl(trimethyl)silane is sourced from PubChem (CID 166444731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).