(E,3S)-1-triethylsilyloct-1-en-3-ol

C14H30OSi — CID 10377101

IUPAC(E,3S)-1-triethylsilyloct-1-en-3-ol
SMILESCCCCC[C@H](O)/C=C/[Si](CC)(CC)CC
InChIInChI=1S/C14H30OSi/c1-5-9-10-11-14(15)12-13-16(6-2,7-3)8-4/h12-15H,5-11H2,1-4H3/b13-12+/t14-/m0/s1
InChIKeyJYEFEJBSTNZWRP-FNDVETGQSA-N
MW242.48 g/mol
LogP4.53
Rot. Bonds9

About (E,3S)-1-triethylsilyloct-1-en-3-ol

(E,3S)-1-triethylsilyloct-1-en-3-ol (PubChem CID 10377101) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is (E,3S)-1-triethylsilyloct-1-en-3-ol.

Molecular Properties

Compound Name(E,3S)-1-triethylsilyloct-1-en-3-ol
PubChem CID10377101
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Name(E,3S)-1-triethylsilyloct-1-en-3-ol
SMILESCCCCC[C@H](O)/C=C/[Si](CC)(CC)CC
InChIInChI=1S/C14H30OSi/c1-5-9-10-11-14(15)12-13-16(6-2,7-3)8-4/h12-15H,5-11H2,1-4H3/b13-12+/t14-/m0/s1
InChIKeyJYEFEJBSTNZWRP-FNDVETGQSA-N
XLogP4.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.48
LogP ≤ 54.53
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'}

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Related Compounds

(E)-1-triethylsilylnon-1-en-4-ol
CID 102596355
(Z)-undec-2-en-4-ol
CID 14320443
(E,3S)-1-iodooct-1-en-3-ol
CID 10988815
(E)-1-chlorooct-1-en-3-ol
CID 14723484
(3S)-1-iodooct-1-en-3-ol
CID 54007858
(3R)-1-iodooct-1-en-3-ol
CID 54007857
(E,3S)-1-deuterio-1-trimethylsilyloct-1-en-3-ol
CID 11084880
(E)-non-2-ene-1,4-diol
CID 14106146
octadec-3-en-5-ol
CID 144649733
(E,4R)-non-2-ene-1,4-diol
CID 11030095
triethyl-[(E)-1-triethylsilyloct-1-en-3-yl]oxysilane
CID 10428374
(4S)-4-hydroxynon-2-enal
CID 173082436

Frequently Asked Questions

What is the IUPAC name of (E,3S)-1-triethylsilyloct-1-en-3-ol?
The IUPAC name of (E,3S)-1-triethylsilyloct-1-en-3-ol (CID 10377101) is (E,3S)-1-triethylsilyloct-1-en-3-ol.
What is the SMILES notation for (E,3S)-1-triethylsilyloct-1-en-3-ol?
The canonical SMILES for (E,3S)-1-triethylsilyloct-1-en-3-ol is CCCCC[C@H](O)/C=C/[Si](CC)(CC)CC.
What is the InChIKey of (E,3S)-1-triethylsilyloct-1-en-3-ol?
The InChIKey is JYEFEJBSTNZWRP-FNDVETGQSA-N. The full InChI is InChI=1S/C14H30OSi/c1-5-9-10-11-14(15)12-13-16(6-2,7-3)8-4/h12-15H,5-11H2,1-4H3/b13-12+/t14-/m0/s1.
What are the key properties of (E,3S)-1-triethylsilyloct-1-en-3-ol?
(E,3S)-1-triethylsilyloct-1-en-3-ol has a molecular weight of 242.48 g/mol, XLogP of 4.53, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,3S)-1-triethylsilyloct-1-en-3-ol is sourced from PubChem (CID 10377101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).