trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane

C20H40Si4 — CID 11200203

IUPACtrimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane
SMILESC[Si](C)(C)C#CC1=C(C[Si](C)(C)C)C([Si](C)(C)C)=CC1[Si](C)(C)C
InChIInChI=1S/C20H40Si4/c1-21(2,3)14-13-17-18(16-22(4,5)6)20(24(10,11)12)15-19(17)23(7,8)9/h15,19H,16H2,1-12H3
InChIKeyWWWNHJIMKOOFSD-UHFFFAOYSA-N
MW392.88 g/mol
LogP7.03
Rot. Bonds4

About trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane

trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane (PubChem CID 11200203) has the molecular formula C20H40Si4 and a molecular weight of 392.88 g/mol. Its IUPAC name is trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane
PubChem CID11200203
Molecular FormulaC20H40Si4
Molecular Weight392.88 g/mol
Exact Mass392.22
IUPAC Nametrimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane
SMILESC[Si](C)(C)C#CC1=C(C[Si](C)(C)C)C([Si](C)(C)C)=CC1[Si](C)(C)C
InChIInChI=1S/C20H40Si4/c1-21(2,3)14-13-17-18(16-22(4,5)6)20(24(10,11)12)15-19(17)23(7,8)9/h15,19H,16H2,1-12H3
InChIKeyWWWNHJIMKOOFSD-UHFFFAOYSA-N
XLogP7.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.88
LogP ≤ 57.03
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-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane?
The IUPAC name of trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane (CID 11200203) is trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane.
What is the SMILES notation for trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane?
The canonical SMILES for trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane is C[Si](C)(C)C#CC1=C(C[Si](C)(C)C)C([Si](C)(C)C)=CC1[Si](C)(C)C.
What is the InChIKey of trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane?
The InChIKey is WWWNHJIMKOOFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40Si4/c1-21(2,3)14-13-17-18(16-22(4,5)6)20(24(10,11)12)15-19(17)23(7,8)9/h15,19H,16H2,1-12H3.
What are the key properties of trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane?
trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane has a molecular weight of 392.88 g/mol, XLogP of 7.03, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-trimethylsilyl-4-(2-trimethylsilylethynyl)-5-(trimethylsilylmethyl)cyclopenta-1,4-dien-1-yl]silane is sourced from PubChem (CID 11200203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).