(E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol

C14H30OSi — CID 175789392

IUPAC(E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol
SMILESC/C=C(\CC)CCC(C)CC(O)[Si](C)(C)C
InChIInChI=1S/C14H30OSi/c1-7-13(8-2)10-9-12(3)11-14(15)16(4,5)6/h7,12,14-15H,8-11H2,1-6H3/b13-7+
InChIKeyXFYIZOGMECCRDJ-NTUHNPAUSA-N
MW242.48 g/mol
LogP4.39
Rot. Bonds7

About (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol

(E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol (PubChem CID 175789392) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol.

Molecular Properties

Compound Name(E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol
PubChem CID175789392
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Name(E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol
SMILESC/C=C(\CC)CCC(C)CC(O)[Si](C)(C)C
InChIInChI=1S/C14H30OSi/c1-7-13(8-2)10-9-12(3)11-14(15)16(4,5)6/h7,12,14-15H,8-11H2,1-6H3/b13-7+
InChIKeyXFYIZOGMECCRDJ-NTUHNPAUSA-N
XLogP4.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.48
LogP ≤ 54.39
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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Frequently Asked Questions

What is the IUPAC name of (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol?
The IUPAC name of (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol (CID 175789392) is (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol.
What is the SMILES notation for (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol?
The canonical SMILES for (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol is C/C=C(\CC)CCC(C)CC(O)[Si](C)(C)C.
What is the InChIKey of (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol?
The InChIKey is XFYIZOGMECCRDJ-NTUHNPAUSA-N. The full InChI is InChI=1S/C14H30OSi/c1-7-13(8-2)10-9-12(3)11-14(15)16(4,5)6/h7,12,14-15H,8-11H2,1-6H3/b13-7+.
What are the key properties of (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol?
(E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol has a molecular weight of 242.48 g/mol, XLogP of 4.39, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-ethyl-3-methyl-1-trimethylsilyloct-6-en-1-ol is sourced from PubChem (CID 175789392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).