[(E)-oct-2-enyl]-tripropylsilane

C17H36Si — CID 102146512

IUPAC[(E)-oct-2-enyl]-tripropylsilane
SMILESCCCCC/C=C/C[Si](CCC)(CCC)CCC
InChIInChI=1S/C17H36Si/c1-5-9-10-11-12-13-17-18(14-6-2,15-7-3)16-8-4/h12-13H,5-11,14-17H2,1-4H3/b13-12+
InChIKeyULXJXGLFYNHPRF-OUKQBFOZSA-N
MW268.56 g/mol
LogP6.80
Rot. Bonds12

About [(E)-oct-2-enyl]-tripropylsilane

[(E)-oct-2-enyl]-tripropylsilane (PubChem CID 102146512) has the molecular formula C17H36Si and a molecular weight of 268.56 g/mol. Its IUPAC name is [(E)-oct-2-enyl]-tripropylsilane.

Molecular Properties

Compound Name[(E)-oct-2-enyl]-tripropylsilane
PubChem CID102146512
Molecular FormulaC17H36Si
Molecular Weight268.56 g/mol
Exact Mass268.26
IUPAC Name[(E)-oct-2-enyl]-tripropylsilane
SMILESCCCCC/C=C/C[Si](CCC)(CCC)CCC
InChIInChI=1S/C17H36Si/c1-5-9-10-11-12-13-17-18(14-6-2,15-7-3)16-8-4/h12-13H,5-11,14-17H2,1-4H3/b13-12+
InChIKeyULXJXGLFYNHPRF-OUKQBFOZSA-N
XLogP6.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.56
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
tetratriacont-8-ene
CID 123670593
(E)-icos-10-ene
CID 10468895
heptatriacont-13-ene
CID 71378710
(E)-docos-6-ene
CID 22172020
triacont-12-ene
CID 54535715
(Z)-octadec-6-ene
CID 5352239
(24Z)-hexatriaconta-9,24-diene
CID 173127472
(Z)-heptacos-11-ene
CID 56936074

Frequently Asked Questions

What is the IUPAC name of [(E)-oct-2-enyl]-tripropylsilane?
The IUPAC name of [(E)-oct-2-enyl]-tripropylsilane (CID 102146512) is [(E)-oct-2-enyl]-tripropylsilane.
What is the SMILES notation for [(E)-oct-2-enyl]-tripropylsilane?
The canonical SMILES for [(E)-oct-2-enyl]-tripropylsilane is CCCCC/C=C/C[Si](CCC)(CCC)CCC.
What is the InChIKey of [(E)-oct-2-enyl]-tripropylsilane?
The InChIKey is ULXJXGLFYNHPRF-OUKQBFOZSA-N. The full InChI is InChI=1S/C17H36Si/c1-5-9-10-11-12-13-17-18(14-6-2,15-7-3)16-8-4/h12-13H,5-11,14-17H2,1-4H3/b13-12+.
What are the key properties of [(E)-oct-2-enyl]-tripropylsilane?
[(E)-oct-2-enyl]-tripropylsilane has a molecular weight of 268.56 g/mol, XLogP of 6.80, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-oct-2-enyl]-tripropylsilane is sourced from PubChem (CID 102146512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).