trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane

C17H38OSi2 — CID 101410798

IUPACtrimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane
SMILESCC(C)[Si](/C=C/C(C)(C)O[Si](C)(C)C)(C(C)C)C(C)C
InChIInChI=1S/C17H38OSi2/c1-14(2)20(15(3)4,16(5)6)13-12-17(7,8)18-19(9,10)11/h12-16H,1-11H3/b13-12+
InChIKeyHRJUJWVFLZESRO-OUKQBFOZSA-N
MW314.66 g/mol
LogP6.39
Rot. Bonds7

About trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane

trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane (PubChem CID 101410798) has the molecular formula C17H38OSi2 and a molecular weight of 314.66 g/mol. Its IUPAC name is trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane
PubChem CID101410798
Molecular FormulaC17H38OSi2
Molecular Weight314.66 g/mol
Exact Mass314.25
IUPAC Nametrimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane
SMILESCC(C)[Si](/C=C/C(C)(C)O[Si](C)(C)C)(C(C)C)C(C)C
InChIInChI=1S/C17H38OSi2/c1-14(2)20(15(3)4,16(5)6)13-12-17(7,8)18-19(9,10)11/h12-16H,1-11H3/b13-12+
InChIKeyHRJUJWVFLZESRO-OUKQBFOZSA-N
XLogP6.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.66
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane?
The IUPAC name of trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane (CID 101410798) is trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane.
What is the SMILES notation for trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane?
The canonical SMILES for trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane is CC(C)[Si](/C=C/C(C)(C)O[Si](C)(C)C)(C(C)C)C(C)C.
What is the InChIKey of trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane?
The InChIKey is HRJUJWVFLZESRO-OUKQBFOZSA-N. The full InChI is InChI=1S/C17H38OSi2/c1-14(2)20(15(3)4,16(5)6)13-12-17(7,8)18-19(9,10)11/h12-16H,1-11H3/b13-12+.
What are the key properties of trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane?
trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane has a molecular weight of 314.66 g/mol, XLogP of 6.39, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-2-methyl-4-tri(propan-2-yl)silylbut-3-en-2-yl]oxysilane is sourced from PubChem (CID 101410798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).