[(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane

C20H40OSi — CID 102429051

IUPAC[(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane
SMILESCCCCCC(/C=C/C=C/[Si](C(C)C)(C(C)C)C(C)C)OC
InChIInChI=1S/C20H40OSi/c1-9-10-11-14-20(21-8)15-12-13-16-22(17(2)3,18(4)5)19(6)7/h12-13,15-20H,9-11,14H2,1-8H3/b15-12+,16-13+
InChIKeyUTUVSGLPHOJYGX-WSGPNKEYSA-N
MW324.63 g/mol
LogP6.91
Rot. Bonds11

About [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane

[(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane (PubChem CID 102429051) has the molecular formula C20H40OSi and a molecular weight of 324.63 g/mol. Its IUPAC name is [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane
PubChem CID102429051
Molecular FormulaC20H40OSi
Molecular Weight324.63 g/mol
Exact Mass324.28
IUPAC Name[(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane
SMILESCCCCCC(/C=C/C=C/[Si](C(C)C)(C(C)C)C(C)C)OC
InChIInChI=1S/C20H40OSi/c1-9-10-11-14-20(21-8)15-12-13-16-22(17(2)3,18(4)5)19(6)7/h12-13,15-20H,9-11,14H2,1-8H3/b15-12+,16-13+
InChIKeyUTUVSGLPHOJYGX-WSGPNKEYSA-N
XLogP6.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.63
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane?
The IUPAC name of [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane (CID 102429051) is [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane.
What is the SMILES notation for [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane?
The canonical SMILES for [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane is CCCCCC(/C=C/C=C/[Si](C(C)C)(C(C)C)C(C)C)OC.
What is the InChIKey of [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane?
The InChIKey is UTUVSGLPHOJYGX-WSGPNKEYSA-N. The full InChI is InChI=1S/C20H40OSi/c1-9-10-11-14-20(21-8)15-12-13-16-22(17(2)3,18(4)5)19(6)7/h12-13,15-20H,9-11,14H2,1-8H3/b15-12+,16-13+.
What are the key properties of [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane?
[(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane has a molecular weight of 324.63 g/mol, XLogP of 6.91, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E,3E)-5-methoxydeca-1,3-dienyl]-tri(propan-2-yl)silane is sourced from PubChem (CID 102429051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).