[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane

C18H38OSi2 — CID 135020895

IUPAC[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane
SMILES[2H]C(/C=C\OCC=C)([Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C18H38OSi2/c1-8-16-19-17-15-18(20(9-2,10-3)11-4)21(12-5,13-6)14-7/h8,15,17-18H,1,9-14,16H2,2-7H3/b17-15-/i18D
InChIKeyALDQNWYDFHANOL-AMMIBYQFSA-N
MW327.68 g/mol
LogP6.63
Rot. Bonds12

About [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane

[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane (PubChem CID 135020895) has the molecular formula C18H38OSi2 and a molecular weight of 327.68 g/mol. Its IUPAC name is [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane.

Molecular Properties

Compound Name[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane
PubChem CID135020895
Molecular FormulaC18H38OSi2
Molecular Weight327.68 g/mol
Exact Mass327.25
IUPAC Name[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane
SMILES[2H]C(/C=C\OCC=C)([Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C18H38OSi2/c1-8-16-19-17-15-18(20(9-2,10-3)11-4)21(12-5,13-6)14-7/h8,15,17-18H,1,9-14,16H2,2-7H3/b17-15-/i18D
InChIKeyALDQNWYDFHANOL-AMMIBYQFSA-N
XLogP6.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.68
LogP ≤ 56.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane?
The IUPAC name of [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane (CID 135020895) is [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane.
What is the SMILES notation for [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane?
The canonical SMILES for [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane is [2H]C(/C=C\OCC=C)([Si](CC)(CC)CC)[Si](CC)(CC)CC.
What is the InChIKey of [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane?
The InChIKey is ALDQNWYDFHANOL-AMMIBYQFSA-N. The full InChI is InChI=1S/C18H38OSi2/c1-8-16-19-17-15-18(20(9-2,10-3)11-4)21(12-5,13-6)14-7/h8,15,17-18H,1,9-14,16H2,2-7H3/b17-15-/i18D.
What are the key properties of [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane?
[(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane has a molecular weight of 327.68 g/mol, XLogP of 6.63, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-deuterio-3-prop-2-enoxy-1-triethylsilylprop-2-enyl]-triethylsilane is sourced from PubChem (CID 135020895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).