tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane

C15H32OSi — CID 123655657

IUPACtert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane
SMILESC=CCCC(O[Si](C)(C)C(C)(C)C)C(C)CC
InChIInChI=1S/C15H32OSi/c1-9-11-12-14(13(3)10-2)16-17(7,8)15(4,5)6/h9,13-14H,1,10-12H2,2-8H3
InChIKeyOZBWBVRMCXNHMY-UHFFFAOYSA-N
MW256.51 g/mol
LogP5.39
Rot. Bonds7

About tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane

tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane (PubChem CID 123655657) has the molecular formula C15H32OSi and a molecular weight of 256.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane
PubChem CID123655657
Molecular FormulaC15H32OSi
Molecular Weight256.51 g/mol
Exact Mass256.22
IUPAC Nametert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane
SMILESC=CCCC(O[Si](C)(C)C(C)(C)C)C(C)CC
InChIInChI=1S/C15H32OSi/c1-9-11-12-14(13(3)10-2)16-17(7,8)15(4,5)6/h9,13-14H,1,10-12H2,2-8H3
InChIKeyOZBWBVRMCXNHMY-UHFFFAOYSA-N
XLogP5.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.51
LogP ≤ 55.39
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'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane (CID 123655657) is tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane is C=CCCC(O[Si](C)(C)C(C)(C)C)C(C)CC.
What is the InChIKey of tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane?
The InChIKey is OZBWBVRMCXNHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32OSi/c1-9-11-12-14(13(3)10-2)16-17(7,8)15(4,5)6/h9,13-14H,1,10-12H2,2-8H3.
What are the key properties of tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane?
tert-butyl-dimethyl-(3-methyloct-7-en-4-yloxy)silane has a molecular weight of 256.51 g/mol, XLogP of 5.39, 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-methyloct-7-en-4-yloxy)silane is sourced from PubChem (CID 123655657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).