(E)-8-trimethylsilyloct-2-en-7-yn-1-ol

C11H20OSi — CID 134896986

IUPAC(E)-8-trimethylsilyloct-2-en-7-yn-1-ol
SMILESC[Si](C)(C)C#CCCC/C=C/CO
InChIInChI=1S/C11H20OSi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h6,8,12H,4-5,7,10H2,1-3H3/b8-6+
InChIKeyZLBCQNQMFBOPLY-SOFGYWHQSA-N
MW196.37 g/mol
LogP2.59
Rot. Bonds4

About (E)-8-trimethylsilyloct-2-en-7-yn-1-ol

(E)-8-trimethylsilyloct-2-en-7-yn-1-ol (PubChem CID 134896986) has the molecular formula C11H20OSi and a molecular weight of 196.37 g/mol. Its IUPAC name is (E)-8-trimethylsilyloct-2-en-7-yn-1-ol.

Molecular Properties

Compound Name(E)-8-trimethylsilyloct-2-en-7-yn-1-ol
PubChem CID134896986
Molecular FormulaC11H20OSi
Molecular Weight196.37 g/mol
Exact Mass196.13
IUPAC Name(E)-8-trimethylsilyloct-2-en-7-yn-1-ol
SMILESC[Si](C)(C)C#CCCC/C=C/CO
InChIInChI=1S/C11H20OSi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h6,8,12H,4-5,7,10H2,1-3H3/b8-6+
InChIKeyZLBCQNQMFBOPLY-SOFGYWHQSA-N
XLogP2.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.37
LogP ≤ 52.59
H-Bond Donors ≤ 51
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(2Z,9Z)-pentadecadiene-4,6-diyn-1-ol
CID 14841162
Pentadeca-2,9-dien-4,6-diyn-1-ol
CID 72739887
(E)-3-fluoro-1-tri(propan-2-yl)silylhept-5-en-1-yn-4-ol
CID 10517217
(Z)-2-trimethylsilylhept-2-en-1-ol
CID 11745353
(E)-2-methyl-7-trimethylsilylhept-2-en-6-yn-1-ol
CID 134981587
(Z)-8-trimethylsilyloct-5-en-7-yn-4-ol
CID 10797972
(E,2R)-6-trimethylsilylhex-3-en-5-yn-2-ol
CID 11355705
(Z,2R)-3-trimethylsilyloct-3-en-2-ol
CID 12846918
(E)-1-trimethylsilylhept-5-en-1-yn-4-ol
CID 13357612
(E)-1-trimethylsilyldec-2-en-1-ol
CID 13541828
(2E,5E)-6-trimethylsilylhexa-2,5-dien-1-ol
CID 14290619
(E,1R)-1-[tert-butyl(dimethyl)silyl]hex-2-en-1-ol
CID 24809451

Frequently Asked Questions

What is the IUPAC name of (E)-8-trimethylsilyloct-2-en-7-yn-1-ol?
The IUPAC name of (E)-8-trimethylsilyloct-2-en-7-yn-1-ol (CID 134896986) is (E)-8-trimethylsilyloct-2-en-7-yn-1-ol.
What is the SMILES notation for (E)-8-trimethylsilyloct-2-en-7-yn-1-ol?
The canonical SMILES for (E)-8-trimethylsilyloct-2-en-7-yn-1-ol is C[Si](C)(C)C#CCCC/C=C/CO.
What is the InChIKey of (E)-8-trimethylsilyloct-2-en-7-yn-1-ol?
The InChIKey is ZLBCQNQMFBOPLY-SOFGYWHQSA-N. The full InChI is InChI=1S/C11H20OSi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h6,8,12H,4-5,7,10H2,1-3H3/b8-6+.
What are the key properties of (E)-8-trimethylsilyloct-2-en-7-yn-1-ol?
(E)-8-trimethylsilyloct-2-en-7-yn-1-ol has a molecular weight of 196.37 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-8-trimethylsilyloct-2-en-7-yn-1-ol is sourced from PubChem (CID 134896986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).