[(E)-3,3-dimethylbut-1-enyl]-triethylsilane

C12H26Si — CID 11074376

IUPAC[(E)-3,3-dimethylbut-1-enyl]-triethylsilane
SMILESCC[Si](/C=C/C(C)(C)C)(CC)CC
InChIInChI=1S/C12H26Si/c1-7-13(8-2,9-3)11-10-12(4,5)6/h10-11H,7-9H2,1-6H3/b11-10+
InChIKeyNMCXIZRJYSJQHC-ZHACJKMWSA-N
MW198.43 g/mol
LogP4.64
Rot. Bonds4

About [(E)-3,3-dimethylbut-1-enyl]-triethylsilane

[(E)-3,3-dimethylbut-1-enyl]-triethylsilane (PubChem CID 11074376) has the molecular formula C12H26Si and a molecular weight of 198.43 g/mol. Its IUPAC name is [(E)-3,3-dimethylbut-1-enyl]-triethylsilane.

Molecular Properties

Compound Name[(E)-3,3-dimethylbut-1-enyl]-triethylsilane
PubChem CID11074376
Molecular FormulaC12H26Si
Molecular Weight198.43 g/mol
Exact Mass198.18
IUPAC Name[(E)-3,3-dimethylbut-1-enyl]-triethylsilane
SMILESCC[Si](/C=C/C(C)(C)C)(CC)CC
InChIInChI=1S/C12H26Si/c1-7-13(8-2,9-3)11-10-12(4,5)6/h10-11H,7-9H2,1-6H3/b11-10+
InChIKeyNMCXIZRJYSJQHC-ZHACJKMWSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.43
LogP ≤ 54.64
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 [(E)-3,3-dimethylbut-1-enyl]-triethylsilane?
The IUPAC name of [(E)-3,3-dimethylbut-1-enyl]-triethylsilane (CID 11074376) is [(E)-3,3-dimethylbut-1-enyl]-triethylsilane.
What is the SMILES notation for [(E)-3,3-dimethylbut-1-enyl]-triethylsilane?
The canonical SMILES for [(E)-3,3-dimethylbut-1-enyl]-triethylsilane is CC[Si](/C=C/C(C)(C)C)(CC)CC.
What is the InChIKey of [(E)-3,3-dimethylbut-1-enyl]-triethylsilane?
The InChIKey is NMCXIZRJYSJQHC-ZHACJKMWSA-N. The full InChI is InChI=1S/C12H26Si/c1-7-13(8-2,9-3)11-10-12(4,5)6/h10-11H,7-9H2,1-6H3/b11-10+.
What are the key properties of [(E)-3,3-dimethylbut-1-enyl]-triethylsilane?
[(E)-3,3-dimethylbut-1-enyl]-triethylsilane has a molecular weight of 198.43 g/mol, XLogP of 4.64, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3,3-dimethylbut-1-enyl]-triethylsilane is sourced from PubChem (CID 11074376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).