tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane

C17H30OSi — CID 139252750

IUPACtert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane
SMILESC#CCCC(=C)CC(CC=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H30OSi/c1-9-11-13-15(3)14-16(12-10-2)18-19(7,8)17(4,5)6/h1,10,16H,2-3,11-14H2,4-8H3
InChIKeyHZYYZTVOTSBYFD-UHFFFAOYSA-N
MW278.51 g/mol
LogP5.31
Rot. Bonds8

About tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane

tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane (PubChem CID 139252750) has the molecular formula C17H30OSi and a molecular weight of 278.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane
PubChem CID139252750
Molecular FormulaC17H30OSi
Molecular Weight278.51 g/mol
Exact Mass278.21
IUPAC Nametert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane
SMILESC#CCCC(=C)CC(CC=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H30OSi/c1-9-11-13-15(3)14-16(12-10-2)18-19(7,8)17(4,5)6/h1,10,16H,2-3,11-14H2,4-8H3
InChIKeyHZYYZTVOTSBYFD-UHFFFAOYSA-N
XLogP5.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.51
LogP ≤ 55.31
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 tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane (CID 139252750) is tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane is C#CCCC(=C)CC(CC=C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane?
The InChIKey is HZYYZTVOTSBYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30OSi/c1-9-11-13-15(3)14-16(12-10-2)18-19(7,8)17(4,5)6/h1,10,16H,2-3,11-14H2,4-8H3.
What are the key properties of tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane?
tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane has a molecular weight of 278.51 g/mol, XLogP of 5.31, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-4-yloxy)silane is sourced from PubChem (CID 139252750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).