2-(cyclobuten-1-yl)ethyl-trimethylsilane

C9H18Si — CID 139263553

IUPAC2-(cyclobuten-1-yl)ethyl-trimethylsilane
SMILESC[Si](C)(C)CCC1=CCC1
InChIInChI=1S/C9H18Si/c1-10(2,3)8-7-9-5-4-6-9/h5H,4,6-8H2,1-3H3
InChIKeyGRVHPDVLBLOOIG-UHFFFAOYSA-N
MW154.33 g/mol
LogP3.43
Rot. Bonds3

About 2-(cyclobuten-1-yl)ethyl-trimethylsilane

2-(cyclobuten-1-yl)ethyl-trimethylsilane (PubChem CID 139263553) has the molecular formula C9H18Si and a molecular weight of 154.33 g/mol. Its IUPAC name is 2-(cyclobuten-1-yl)ethyl-trimethylsilane.

Molecular Properties

Compound Name2-(cyclobuten-1-yl)ethyl-trimethylsilane
PubChem CID139263553
Molecular FormulaC9H18Si
Molecular Weight154.33 g/mol
Exact Mass154.12
IUPAC Name2-(cyclobuten-1-yl)ethyl-trimethylsilane
SMILESC[Si](C)(C)CCC1=CCC1
InChIInChI=1S/C9H18Si/c1-10(2,3)8-7-9-5-4-6-9/h5H,4,6-8H2,1-3H3
InChIKeyGRVHPDVLBLOOIG-UHFFFAOYSA-N
XLogP3.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.33
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Silane, (1-cyclohexen-1-ylmethyl)trimethyl-
CID 10964921
Silane, (2-cyclohexylideneethyl)trimethyl-
CID 10976133
((2E)-3,7-Dimethyl-2,6-octadien-1-yl)trimethylsilane
CID 10954825
2-Cyclohexylideneethyl(triethyl)silane
CID 102587173
(2,4-Dimethylcyclohexa-1,4-dien-1-yl)-trimethylsilane
CID 134857856
2-(Cyclopenten-1-yl)ethyl-trimethylsilane
CID 139263552
2-(Cyclohexen-1-yl)ethyl-trimethylsilane
CID 18764452
3,7-Dimethyl-2,6-octadiene, 1-dimethylfluorosilyl-1-trimethylsilyl-
CID 5371444
Cyclopentene, 1-trimethylsilyl-2-methyl-4-methylene-
CID 552257
Silane, (1-cyclopenten-1-ylmethyl)trimethyl-
CID 553182
1,1,4-trimethyl-3,6-dihydro-2H-siline
CID 10920606
trimethyl-[(E)-undec-5-en-5-yl]silane
CID 11107073

Frequently Asked Questions

What is the IUPAC name of 2-(cyclobuten-1-yl)ethyl-trimethylsilane?
The IUPAC name of 2-(cyclobuten-1-yl)ethyl-trimethylsilane (CID 139263553) is 2-(cyclobuten-1-yl)ethyl-trimethylsilane.
What is the SMILES notation for 2-(cyclobuten-1-yl)ethyl-trimethylsilane?
The canonical SMILES for 2-(cyclobuten-1-yl)ethyl-trimethylsilane is C[Si](C)(C)CCC1=CCC1.
What is the InChIKey of 2-(cyclobuten-1-yl)ethyl-trimethylsilane?
The InChIKey is GRVHPDVLBLOOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18Si/c1-10(2,3)8-7-9-5-4-6-9/h5H,4,6-8H2,1-3H3.
What are the key properties of 2-(cyclobuten-1-yl)ethyl-trimethylsilane?
2-(cyclobuten-1-yl)ethyl-trimethylsilane has a molecular weight of 154.33 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobuten-1-yl)ethyl-trimethylsilane is sourced from PubChem (CID 139263553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).