tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane

C16H30OSi — CID 122395882

IUPACtert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane
SMILESC#CC(C)(CCCCC=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30OSi/c1-9-11-12-13-14-16(6,10-2)17-18(7,8)15(3,4)5/h2,9H,1,11-14H2,3-8H3
InChIKeyNKUKVKLDWHLKDW-UHFFFAOYSA-N
MW266.50 g/mol
LogP5.15
Rot. Bonds7

About tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane

tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane (PubChem CID 122395882) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane
PubChem CID122395882
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Nametert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane
SMILESC#CC(C)(CCCCC=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30OSi/c1-9-11-12-13-14-16(6,10-2)17-18(7,8)15(3,4)5/h2,9H,1,11-14H2,3-8H3
InChIKeyNKUKVKLDWHLKDW-UHFFFAOYSA-N
XLogP5.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

5-Ethynylnon-1-en-8-yn-5-yloxy(trimethyl)silane
CID 10988206
Triethyl(5-prop-1-ynyldeca-1,9-dien-5-yloxy)silane
CID 11748805
Triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane
CID 14936189
triethyl-[(2S,3R)-2-ethynyl-3-triethylsilyloxyoct-7-en-2-yl]oxysilane
CID 134865990
(R)-tert-butyl((2,6-dimethyloct-7-en-2-yl)oxy)dimethylsilane
CID 162624114
5-Ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane
CID 15247300
Tert-butyl-(5-ethynylnona-1,8-dien-5-yloxy)-dimethylsilane
CID 15247303
(3S,6R)-6-(Tert-butyldimethylsiloxy)-3-methylnonen-8-yne
CID 101618203
Triethyl(5-ethynylnona-1,8-dien-5-yloxy)silane
CID 10826488
3-Ethynyloct-1-en-3-yloxy(trimethyl)silane
CID 12786194
4-Methyl-4-trimethylsilyloxy-oct-1-yn-7-ene
CID 12786233
4,7-Dimethylnon-8-en-1-yn-4-yloxy(trimethyl)silane
CID 19853182

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane (CID 122395882) is tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane is C#CC(C)(CCCCC=C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane?
The InChIKey is NKUKVKLDWHLKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi/c1-9-11-12-13-14-16(6,10-2)17-18(7,8)15(3,4)5/h2,9H,1,11-14H2,3-8H3.
What are the key properties of tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane?
tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane has a molecular weight of 266.50 g/mol, XLogP of 5.15, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane is sourced from PubChem (CID 122395882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).