dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane

C14H22Si — CID 10443398

IUPACdimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane
SMILESC/C=C(\C)C(C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H22Si/c1-6-12(2)13(3)15(4,5)14-10-8-7-9-11-14/h6-11,13H,1-5H3/b12-6+
InChIKeyGEUXETKJDYEUJC-WUXMJOGZSA-N
MW218.42 g/mol
LogP3.96
Rot. Bonds3

About dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane

dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane (PubChem CID 10443398) has the molecular formula C14H22Si and a molecular weight of 218.42 g/mol. Its IUPAC name is dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane.

Molecular Properties

Compound Namedimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane
PubChem CID10443398
Molecular FormulaC14H22Si
Molecular Weight218.42 g/mol
Exact Mass218.15
IUPAC Namedimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane
SMILESC/C=C(\C)C(C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H22Si/c1-6-12(2)13(3)15(4,5)14-10-8-7-9-11-14/h6-11,13H,1-5H3/b12-6+
InChIKeyGEUXETKJDYEUJC-WUXMJOGZSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.42
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane?
The IUPAC name of dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane (CID 10443398) is dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane.
What is the SMILES notation for dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane?
The canonical SMILES for dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane is C/C=C(\C)C(C)[Si](C)(C)c1ccccc1.
What is the InChIKey of dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane?
The InChIKey is GEUXETKJDYEUJC-WUXMJOGZSA-N. The full InChI is InChI=1S/C14H22Si/c1-6-12(2)13(3)15(4,5)14-10-8-7-9-11-14/h6-11,13H,1-5H3/b12-6+.
What are the key properties of dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane?
dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane has a molecular weight of 218.42 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(E)-3-methylpent-3-en-2-yl]-phenylsilane is sourced from PubChem (CID 10443398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).