[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane

C12H16Si — CID 11263945

IUPAC[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane
SMILESC=C/C=C/[Si](C)(C)c1ccccc1
InChIInChI=1S/C12H16Si/c1-4-5-11-13(2,3)12-9-7-6-8-10-12/h4-11H,1H2,2-3H3/b11-5+
InChIKeyXSVRLXPVIYBULY-VZUCSPMQSA-N
MW188.35 g/mol
LogP2.88
Rot. Bonds3

About [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane

[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane (PubChem CID 11263945) has the molecular formula C12H16Si and a molecular weight of 188.35 g/mol. Its IUPAC name is [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane.

Molecular Properties

Compound Name[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane
PubChem CID11263945
Molecular FormulaC12H16Si
Molecular Weight188.35 g/mol
Exact Mass188.10
IUPAC Name[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane
SMILESC=C/C=C/[Si](C)(C)c1ccccc1
InChIInChI=1S/C12H16Si/c1-4-5-11-13(2,3)12-9-7-6-8-10-12/h4-11H,1H2,2-3H3/b11-5+
InChIKeyXSVRLXPVIYBULY-VZUCSPMQSA-N
XLogP2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.35
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dimethyl-penta-1,4-dienyl-phenylsilane
CID 69411193
(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane
CID 102085704
trichloro-[(E)-2-[dimethyl(phenyl)silyl]ethenyl]silane
CID 23269562
(E)-3-[dimethyl(phenyl)silyl]prop-2-enoic acid
CID 10104447
(1E,3S,4S)-1-[dimethyl(phenyl)silyl]-2,4-dimethylhexa-1,5-dien-3-ol
CID 162415777
[(2E,4Z)-hepta-2,4,6-trien-3-yl]-dimethyl-phenylsilane
CID 174010632
dimethyl-pent-1-enyl-phenylsilane
CID 154195285
[(Z)-2-[3-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethenyl]-dimethyl-phenylsilane
CID 11718251
[4-[dimethyl-[(Z)-2-phenylethenyl]silyl]phenyl]-dimethyl-[(Z)-2-phenylethenyl]silane
CID 101344758
dimethyl-[(4Z)-2-methylhepta-4,6-dien-3-yl]-phenylsilane
CID 10514472
dimethyl-[(E)-2-(2-methylphenyl)ethenyl]-phenylsilane
CID 135061713
dimethyl-[(Z)-2-(2-methylphenyl)ethenyl]-phenylsilane
CID 11528952

Frequently Asked Questions

What is the IUPAC name of [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane?
The IUPAC name of [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane (CID 11263945) is [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane.
What is the SMILES notation for [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane?
The canonical SMILES for [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane is C=C/C=C/[Si](C)(C)c1ccccc1.
What is the InChIKey of [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane?
The InChIKey is XSVRLXPVIYBULY-VZUCSPMQSA-N. The full InChI is InChI=1S/C12H16Si/c1-4-5-11-13(2,3)12-9-7-6-8-10-12/h4-11H,1H2,2-3H3/b11-5+.
What are the key properties of [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane?
[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane has a molecular weight of 188.35 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane is sourced from PubChem (CID 11263945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).