trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane

C19H26Si — CID 101342555

IUPACtrimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane
SMILESCC1=C(C)C(C)(C#C/C=C/C#C[Si](C)(C)C)C(C)=C1C
InChIInChI=1S/C19H26Si/c1-15-16(2)18(4)19(5,17(15)3)13-11-9-10-12-14-20(6,7)8/h9-10H,1-8H3/b10-9+
InChIKeyIKOHHKNRHSBQBV-MDZDMXLPSA-N
MW282.50 g/mol
LogP5.12
Rot. Bonds

About trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane

trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane (PubChem CID 101342555) has the molecular formula C19H26Si and a molecular weight of 282.50 g/mol. Its IUPAC name is trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane
PubChem CID101342555
Molecular FormulaC19H26Si
Molecular Weight282.50 g/mol
Exact Mass282.18
IUPAC Nametrimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane
SMILESCC1=C(C)C(C)(C#C/C=C/C#C[Si](C)(C)C)C(C)=C1C
InChIInChI=1S/C19H26Si/c1-15-16(2)18(4)19(5,17(15)3)13-11-9-10-12-14-20(6,7)8/h9-10H,1-8H3/b10-9+
InChIKeyIKOHHKNRHSBQBV-MDZDMXLPSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.50
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', '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)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane?
The IUPAC name of trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane (CID 101342555) is trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane.
What is the SMILES notation for trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane?
The canonical SMILES for trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane is CC1=C(C)C(C)(C#C/C=C/C#C[Si](C)(C)C)C(C)=C1C.
What is the InChIKey of trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane?
The InChIKey is IKOHHKNRHSBQBV-MDZDMXLPSA-N. The full InChI is InChI=1S/C19H26Si/c1-15-16(2)18(4)19(5,17(15)3)13-11-9-10-12-14-20(6,7)8/h9-10H,1-8H3/b10-9+.
What are the key properties of trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane?
trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane has a molecular weight of 282.50 g/mol, XLogP of 5.12, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-6-(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)hex-3-en-1,5-diynyl]silane is sourced from PubChem (CID 101342555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).