trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane

C11H20Si — CID 552276

IUPACtrimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane
SMILESCC1=C([Si](C)(C)C)C=CC1(C)C
InChIInChI=1S/C11H20Si/c1-9-10(12(4,5)6)7-8-11(9,2)3/h7-8H,1-6H3
InChIKeyPSQIUDSCVQRSRN-UHFFFAOYSA-N
MW180.37 g/mol
LogP3.78
Rot. Bonds1

About trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane

trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane (PubChem CID 552276) has the molecular formula C11H20Si and a molecular weight of 180.37 g/mol. Its IUPAC name is trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane.

Molecular Properties

Compound Nametrimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane
PubChem CID552276
Molecular FormulaC11H20Si
Molecular Weight180.37 g/mol
Exact Mass180.13
IUPAC Nametrimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane
SMILESCC1=C([Si](C)(C)C)C=CC1(C)C
InChIInChI=1S/C11H20Si/c1-9-10(12(4,5)6)7-8-11(9,2)3/h7-8H,1-6H3
InChIKeyPSQIUDSCVQRSRN-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.37
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane?
The IUPAC name of trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane (CID 552276) is trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane.
What is the SMILES notation for trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane?
The canonical SMILES for trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane is CC1=C([Si](C)(C)C)C=CC1(C)C.
What is the InChIKey of trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane?
The InChIKey is PSQIUDSCVQRSRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20Si/c1-9-10(12(4,5)6)7-8-11(9,2)3/h7-8H,1-6H3.
What are the key properties of trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane?
trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane has a molecular weight of 180.37 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2,3,3-trimethylcyclopenta-1,4-dien-1-yl)silane is sourced from PubChem (CID 552276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).