(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane

C24H34Si2 — CID 102085704

IUPAC(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane
SMILESCC(C)(C)c1ccc([Si](C)(C)/C=C\C=C\[Si](C)(C)c2ccccc2)cc1
InChIInChI=1S/C24H34Si2/c1-24(2,3)21-15-17-23(18-16-21)26(6,7)20-12-11-19-25(4,5)22-13-9-8-10-14-22/h8-20H,1-7H3/b19-11+,20-12-
InChIKeyMVOQZWIBJXOSBQ-ZZUVKVOASA-N
MW378.71 g/mol
LogP5.71
Rot. Bonds5

About (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane

(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane (PubChem CID 102085704) has the molecular formula C24H34Si2 and a molecular weight of 378.71 g/mol. Its IUPAC name is (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane.

Molecular Properties

Compound Name(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane
PubChem CID102085704
Molecular FormulaC24H34Si2
Molecular Weight378.71 g/mol
Exact Mass378.22
IUPAC Name(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane
SMILESCC(C)(C)c1ccc([Si](C)(C)/C=C\C=C\[Si](C)(C)c2ccccc2)cc1
InChIInChI=1S/C24H34Si2/c1-24(2,3)21-15-17-23(18-16-21)26(6,7)20-12-11-19-25(4,5)22-13-9-8-10-14-22/h8-20H,1-7H3/b19-11+,20-12-
InChIKeyMVOQZWIBJXOSBQ-ZZUVKVOASA-N
XLogP5.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.71
LogP ≤ 55.71
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

[(1E)-buta-1,3-dienyl]-dimethyl-phenylsilane
CID 11263945
[(E)-4-[dimethyl(phenyl)silyl]but-1-en-3-ynyl]-dimethyl-[4-(trifluoromethyl)phenyl]silane
CID 16664042
[4-[dimethyl-[(Z)-2-phenylethenyl]silyl]phenyl]-dimethyl-[(Z)-2-phenylethenyl]silane
CID 101344758
2-(4-tert-butylphenyl)propan-2-yl-triphenylsilane
CID 164928453
trichloro-[(E)-2-[dimethyl(phenyl)silyl]ethenyl]silane
CID 23269562
(4-tert-butylphenyl)-trimethylsilane
CID 605751
[(E)-3-tert-butylsulfanylprop-1-enyl]-dimethyl-phenylsilane
CID 15737825
(E)-3-[dimethyl(phenyl)silyl]prop-2-enoic acid
CID 10104447
CID 171375456
CID 171375456
dimethyl-penta-1,4-dienyl-phenylsilane
CID 69411193
[(Z)-2-[3-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethenyl]-dimethyl-phenylsilane
CID 11718251
dimethyl-pent-1-enyl-phenylsilane
CID 154195285

Frequently Asked Questions

What is the IUPAC name of (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane?
The IUPAC name of (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane (CID 102085704) is (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane.
What is the SMILES notation for (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane?
The canonical SMILES for (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane is CC(C)(C)c1ccc([Si](C)(C)/C=C\C=C\[Si](C)(C)c2ccccc2)cc1.
What is the InChIKey of (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane?
The InChIKey is MVOQZWIBJXOSBQ-ZZUVKVOASA-N. The full InChI is InChI=1S/C24H34Si2/c1-24(2,3)21-15-17-23(18-16-21)26(6,7)20-12-11-19-25(4,5)22-13-9-8-10-14-22/h8-20H,1-7H3/b19-11+,20-12-.
What are the key properties of (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane?
(4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane has a molecular weight of 378.71 g/mol, XLogP of 5.71, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butylphenyl)-[(1Z,3E)-4-[dimethyl(phenyl)silyl]buta-1,3-dienyl]-dimethylsilane is sourced from PubChem (CID 102085704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).