tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane

C18H36GeOSi — CID 102240613

IUPACtert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane
SMILESC=CCC(C)(C)C(C#C[Ge](C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H36GeOSi/c1-12-14-18(5,6)16(13-15-19(7,8)9)20-21(10,11)17(2,3)4/h12,16H,1,14H2,2-11H3
InChIKeyFTSNFHVVKILLLV-UHFFFAOYSA-N
MW369.18 g/mol
LogP5.86
Rot. Bonds5

About tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane

tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane (PubChem CID 102240613) has the molecular formula C18H36GeOSi and a molecular weight of 369.18 g/mol. Its IUPAC name is tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane
PubChem CID102240613
Molecular FormulaC18H36GeOSi
Molecular Weight369.18 g/mol
Exact Mass370.17
IUPAC Nametert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane
SMILESC=CCC(C)(C)C(C#C[Ge](C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H36GeOSi/c1-12-14-18(5,6)16(13-15-19(7,8)9)20-21(10,11)17(2,3)4/h12,16H,1,14H2,2-11H3
InChIKeyFTSNFHVVKILLLV-UHFFFAOYSA-N
XLogP5.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.18
LogP ≤ 55.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Tert-butyl-(4,4-dimethylhept-6-en-1-yn-3-yloxy)-dimethylsilane
CID 10944928
Tert-butyl-dimethyl-(1-trimethylsilylhept-6-en-1-yn-3-yloxy)silane
CID 11173984
Tert-butyl-(4,4-dimethyl-1-trimethylsilylhept-6-en-1-yn-3-yl)oxy-dimethylsilane
CID 11782316
Tert-butyl-(5,5-dimethyloct-7-en-2-yn-4-yloxy)-dimethylsilane
CID 15317059
tert-butyl-dimethyl-[(4S,5S)-3,3,5-trimethyloct-1-en-6-yn-4-yl]oxysilane
CID 24179532
tert-butyl-[(4S)-3,3-dimethyloct-7-en-1-yn-4-yl]oxy-dimethylsilane
CID 53392206
Tert-butyl-(4,4-dimethylhept-1-en-6-yn-3-yloxy)-dimethylsilane
CID 101111972
tert-butyl-[(3S)-9,9-dimethyl-8-tri(propan-2-yl)silyloxydodec-11-en-1,6-diyn-3-yl]oxy-dimethylsilane
CID 134865047
(5R)-6,6-dimethyl-1-tri(propan-2-yl)silylnon-8-en-1,3-diyn-5-ol
CID 135019970
tert-butyl-dimethyl-[(3S,4R)-4-methyl-1-trimethylsilylhept-6-en-1-yn-3-yl]oxysilane
CID 135042365
Tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxy-7-trimethylgermylhept-1-en-6-yn-4-yl]-dimethylsilane
CID 135077532
Tert-butyl-dimethyl-(1-trimethylgermylhept-6-en-1-yn-3-yloxy)silane
CID 135078607

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane (CID 102240613) is tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane is C=CCC(C)(C)C(C#C[Ge](C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane?
The InChIKey is FTSNFHVVKILLLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36GeOSi/c1-12-14-18(5,6)16(13-15-19(7,8)9)20-21(10,11)17(2,3)4/h12,16H,1,14H2,2-11H3.
What are the key properties of tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane?
tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane has a molecular weight of 369.18 g/mol, XLogP of 5.86, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(4,4-dimethyl-1-trimethylgermylhept-6-en-1-yn-3-yl)oxy-dimethylsilane is sourced from PubChem (CID 102240613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).