(1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol

C11H22OSi — CID 14445782

IUPAC(1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol
SMILESCC/C=C\C[C@@H](O)/C=C/[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-5-6-7-8-11(12)9-10-13(2,3)4/h6-7,9-12H,5,8H2,1-4H3/b7-6-,10-9+/t11-/m1/s1
InChIKeyLCBPKVIBGDXILG-IHHGUDBSSA-N
MW198.38 g/mol
LogP3.14
Rot. Bonds5

About (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol

(1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol (PubChem CID 14445782) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol.

Molecular Properties

Compound Name(1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol
PubChem CID14445782
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name(1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol
SMILESCC/C=C\C[C@@H](O)/C=C/[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-5-6-7-8-11(12)9-10-13(2,3)4/h6-7,9-12H,5,8H2,1-4H3/b7-6-,10-9+/t11-/m1/s1
InChIKeyLCBPKVIBGDXILG-IHHGUDBSSA-N
XLogP3.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,5-Octadien-3-ol
CID 205986
(5E)-octa-1,5-dien-3-ol
CID 6428570
(Z)-1,5-Octadien-3-ol
CID 6430307
(3R,5E)-octa-1,5-dien-3-ol
CID 87509936
5-(Trimethylsilyl)pent-3-en-1-ol
CID 13837971
(Z)-5-trimethylsilylpent-4-en-2-ol
CID 11480588
(5E)-nona-1,5-dien-4-ol
CID 10931514
Undeca-1,5,8-trien-3-ol
CID 71360907
(3S,5Z)-octa-1,5-dien-3-ol
CID 92973648
(3R,5Z)-octa-1,5-dien-3-ol
CID 87509629
(E)-6-trimethylsilylhex-5-en-3-ol
CID 10702355
(Z)-8-trimethylsilyloct-5-en-7-yn-4-ol
CID 10797972

Frequently Asked Questions

What is the IUPAC name of (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol?
The IUPAC name of (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol (CID 14445782) is (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol.
What is the SMILES notation for (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol?
The canonical SMILES for (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol is CC/C=C\C[C@@H](O)/C=C/[Si](C)(C)C.
What is the InChIKey of (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol?
The InChIKey is LCBPKVIBGDXILG-IHHGUDBSSA-N. The full InChI is InChI=1S/C11H22OSi/c1-5-6-7-8-11(12)9-10-13(2,3)4/h6-7,9-12H,5,8H2,1-4H3/b7-6-,10-9+/t11-/m1/s1.
What are the key properties of (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol?
(1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol has a molecular weight of 198.38 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,3R,5Z)-1-trimethylsilylocta-1,5-dien-3-ol is sourced from PubChem (CID 14445782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).