(3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane

C12H24Si — CID 10488148

IUPAC(3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane
SMILESCCCCC12CC([Si](C)(C)C)(C1)C2
InChIInChI=1S/C12H24Si/c1-5-6-7-11-8-12(9-11,10-11)13(2,3)4/h5-10H2,1-4H3
InChIKeyFZCLMVDPZFCFFZ-UHFFFAOYSA-N
MW196.41 g/mol
LogP4.44
Rot. Bonds4

About (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane

(3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane (PubChem CID 10488148) has the molecular formula C12H24Si and a molecular weight of 196.41 g/mol. Its IUPAC name is (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane.

Molecular Properties

Compound Name(3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane
PubChem CID10488148
Molecular FormulaC12H24Si
Molecular Weight196.41 g/mol
Exact Mass196.16
IUPAC Name(3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane
SMILESCCCCC12CC([Si](C)(C)C)(C1)C2
InChIInChI=1S/C12H24Si/c1-5-6-7-11-8-12(9-11,10-11)13(2,3)4/h5-10H2,1-4H3
InChIKeyFZCLMVDPZFCFFZ-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.41
LogP ≤ 54.44
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 (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane?
The IUPAC name of (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane (CID 10488148) is (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane.
What is the SMILES notation for (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane?
The canonical SMILES for (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane is CCCCC12CC([Si](C)(C)C)(C1)C2.
What is the InChIKey of (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane?
The InChIKey is FZCLMVDPZFCFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24Si/c1-5-6-7-11-8-12(9-11,10-11)13(2,3)4/h5-10H2,1-4H3.
What are the key properties of (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane?
(3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane has a molecular weight of 196.41 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-butyl-1-bicyclo[1.1.1]pentanyl)-trimethylsilane is sourced from PubChem (CID 10488148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).