trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane

C24H30Si2 — CID 135024062

IUPACtrimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane
SMILESC[Si](C)(C)C#CC(/C=C/c1ccccc1)=C(/c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C24H30Si2/c1-25(2,3)20-19-23(18-17-21-13-9-7-10-14-21)24(26(4,5)6)22-15-11-8-12-16-22/h7-18H,1-6H3/b18-17+,24-23-
InChIKeyQOGARHBKITWVFN-NNCDFJCWSA-N
MW374.68 g/mol
LogP6.91
Rot. Bonds4

About trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane

trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane (PubChem CID 135024062) has the molecular formula C24H30Si2 and a molecular weight of 374.68 g/mol. Its IUPAC name is trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane
PubChem CID135024062
Molecular FormulaC24H30Si2
Molecular Weight374.68 g/mol
Exact Mass374.19
IUPAC Nametrimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane
SMILESC[Si](C)(C)C#CC(/C=C/c1ccccc1)=C(/c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C24H30Si2/c1-25(2,3)20-19-23(18-17-21-13-9-7-10-14-21)24(26(4,5)6)22-15-11-8-12-16-22/h7-18H,1-6H3/b18-17+,24-23-
InChIKeyQOGARHBKITWVFN-NNCDFJCWSA-N
XLogP6.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.68
LogP ≤ 56.91
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane?
The IUPAC name of trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane (CID 135024062) is trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane.
What is the SMILES notation for trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane?
The canonical SMILES for trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane is C[Si](C)(C)C#CC(/C=C/c1ccccc1)=C(/c1ccccc1)[Si](C)(C)C.
What is the InChIKey of trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane?
The InChIKey is QOGARHBKITWVFN-NNCDFJCWSA-N. The full InChI is InChI=1S/C24H30Si2/c1-25(2,3)20-19-23(18-17-21-13-9-7-10-14-21)24(26(4,5)6)22-15-11-8-12-16-22/h7-18H,1-6H3/b18-17+,24-23-.
What are the key properties of trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane?
trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane has a molecular weight of 374.68 g/mol, XLogP of 6.91, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E,3Z)-5-phenyl-3-[phenyl(trimethylsilyl)methylidene]pent-4-en-1-ynyl]silane is sourced from PubChem (CID 135024062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).