tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane

C13H24OSi — CID 12630484

IUPACtert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane
SMILESC#CC1CCCC1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H24OSi/c1-7-11-9-8-10-12(11)14-15(5,6)13(2,3)4/h1,11-12H,8-10H2,2-6H3
InChIKeyAVAXGFQAMVUIJA-UHFFFAOYSA-N
MW224.42 g/mol
LogP3.81
Rot. Bonds2

About tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane

tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane (PubChem CID 12630484) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane
PubChem CID12630484
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Nametert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane
SMILESC#CC1CCCC1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H24OSi/c1-7-11-9-8-10-12(11)14-15(5,6)13(2,3)4/h1,11-12H,8-10H2,2-6H3
InChIKeyAVAXGFQAMVUIJA-UHFFFAOYSA-N
XLogP3.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

tert-butyl-dimethyl-[(3S)-3-methylhept-6-ynoxy]silane
CID 10705243
trimethyl-[(1R,2S)-2-methylcyclopentyl]oxysilane
CID 11365831
trimethyl-[(1R,2R)-2-methylcyclopentyl]oxysilane
CID 12670197
Tert-butyl-dimethyl-(2-methylhept-6-ynoxy)silane
CID 72961047
lithium tert-butyl-[(1S,2R)-2-methanidylcyclopentyl]oxy-dimethylsilane
CID 134895891
tert-butyl-[(4R)-4-ethylhex-5-ynoxy]-dimethylsilane
CID 138977199
1-Butyl(dimethyl)silyloxy-1-cyclopentylethane
CID 598636
(1-Cyclopentylethoxy)(diisopropyl)silane
CID 6329023
(3S,4R,5S)-4-(tert-Butyldimethylsilyloxy)-3,5-dimethyl-1-heptyne
CID 13970167
1-Cyclopentylethanol, tert-butyldimethylsilyl ether
CID 91697299
(1R,2S)-2-[2-(trimethylsilyl)ethynyl]cyclopentan-1-ol
CID 11116689
tert-Butyl(dimethyl)[(2-methylcyclopentyl)oxy]silane
CID 12663915

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane (CID 12630484) is tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane is C#CC1CCCC1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane?
The InChIKey is AVAXGFQAMVUIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24OSi/c1-7-11-9-8-10-12(11)14-15(5,6)13(2,3)4/h1,11-12H,8-10H2,2-6H3.
What are the key properties of tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane?
tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane has a molecular weight of 224.42 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-ethynylcyclopentyl)oxy-dimethylsilane is sourced from PubChem (CID 12630484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).