[(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane

C9H16Si — CID 170523949

IUPAC[(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane
SMILESC=C/C=C(\C=C)[Si](C)(C)C
InChIInChI=1S/C9H16Si/c1-6-8-9(7-2)10(3,4)5/h6-8H,1-2H2,3-5H3/b9-8+
InChIKeyZPTBLYUWCJRXCM-CMDGGOBGSA-N
MW152.31 g/mol
LogP3.16
Rot. Bonds3

About [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane

[(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane (PubChem CID 170523949) has the molecular formula C9H16Si and a molecular weight of 152.31 g/mol. Its IUPAC name is [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane.

Molecular Properties

Compound Name[(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane
PubChem CID170523949
Molecular FormulaC9H16Si
Molecular Weight152.31 g/mol
Exact Mass152.10
IUPAC Name[(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane
SMILESC=C/C=C(\C=C)[Si](C)(C)C
InChIInChI=1S/C9H16Si/c1-6-8-9(7-2)10(3,4)5/h6-8H,1-2H2,3-5H3/b9-8+
InChIKeyZPTBLYUWCJRXCM-CMDGGOBGSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.31
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane?
The IUPAC name of [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane (CID 170523949) is [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane.
What is the SMILES notation for [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane?
The canonical SMILES for [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane is C=C/C=C(\C=C)[Si](C)(C)C.
What is the InChIKey of [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane?
The InChIKey is ZPTBLYUWCJRXCM-CMDGGOBGSA-N. The full InChI is InChI=1S/C9H16Si/c1-6-8-9(7-2)10(3,4)5/h6-8H,1-2H2,3-5H3/b9-8+.
What are the key properties of [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane?
[(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane has a molecular weight of 152.31 g/mol, XLogP of 3.16, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-hexa-1,3,5-trien-3-yl]-trimethylsilane is sourced from PubChem (CID 170523949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).