trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane

C12H22OSi — CID 57260359

IUPACtrimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane
SMILESC#CC(C)CC(CC=C)O[Si](C)(C)C
InChIInChI=1S/C12H22OSi/c1-7-9-12(10-11(3)8-2)13-14(4,5)6/h2,7,11-12H,1,9-10H2,3-6H3
InChIKeyRDQZQJMZPVJHKL-UHFFFAOYSA-N
MW210.39 g/mol
LogP3.44
Rot. Bonds6

About trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane

trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane (PubChem CID 57260359) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane.

Molecular Properties

Compound Nametrimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane
PubChem CID57260359
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Nametrimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane
SMILESC#CC(C)CC(CC=C)O[Si](C)(C)C
InChIInChI=1S/C12H22OSi/c1-7-9-12(10-11(3)8-2)13-14(4,5)6/h2,7,11-12H,1,9-10H2,3-6H3
InChIKeyRDQZQJMZPVJHKL-UHFFFAOYSA-N
XLogP3.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.44
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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Frequently Asked Questions

What is the IUPAC name of trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane?
The IUPAC name of trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane (CID 57260359) is trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane.
What is the SMILES notation for trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane?
The canonical SMILES for trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane is C#CC(C)CC(CC=C)O[Si](C)(C)C.
What is the InChIKey of trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane?
The InChIKey is RDQZQJMZPVJHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22OSi/c1-7-9-12(10-11(3)8-2)13-14(4,5)6/h2,7,11-12H,1,9-10H2,3-6H3.
What are the key properties of trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane?
trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane has a molecular weight of 210.39 g/mol, XLogP of 3.44, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(6-methyloct-1-en-7-yn-4-yloxy)silane is sourced from PubChem (CID 57260359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).