(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol

C13H28O3Si — CID 102001453

IUPAC(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol
SMILESCCOCCOC/C(=C\[Si](C)(C)C)C(O)CC
InChIInChI=1S/C13H28O3Si/c1-6-13(14)12(11-17(3,4)5)10-16-9-8-15-7-2/h11,13-14H,6-10H2,1-5H3/b12-11+
InChIKeyUBFPSIDQAZGFKM-VAWYXSNFSA-N
MW260.45 g/mol
LogP2.61
Rot. Bonds9

About (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol

(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol (PubChem CID 102001453) has the molecular formula C13H28O3Si and a molecular weight of 260.45 g/mol. Its IUPAC name is (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol.

Molecular Properties

Compound Name(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol
PubChem CID102001453
Molecular FormulaC13H28O3Si
Molecular Weight260.45 g/mol
Exact Mass260.18
IUPAC Name(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol
SMILESCCOCCOC/C(=C\[Si](C)(C)C)C(O)CC
InChIInChI=1S/C13H28O3Si/c1-6-13(14)12(11-17(3,4)5)10-16-9-8-15-7-2/h11,13-14H,6-10H2,1-5H3/b12-11+
InChIKeyUBFPSIDQAZGFKM-VAWYXSNFSA-N
XLogP2.61
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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)-2-(oxolan-2-yl)-3-tri(propan-2-yl)silylprop-2-en-1-ol
CID 138983935
(S)-1-[(tert-butyldimethylsilyloxy)]-4-methyl-4-penten-3-ol
CID 10966327
5-[Tert-butyl(dimethyl)silyl]oxy-2-methylpent-1-en-3-ol
CID 22121311
2-[(3-Hydroxy-2-methylidenepentoxy)methyl]pent-1-en-3-ol
CID 87630287
2-[(2R)-oxan-2-yl]-1-trimethylsilylprop-2-en-1-ol
CID 10375963
(2R)-3-(3-trimethylsilylprop-2-ynoxymethyl)but-3-en-2-ol
CID 11085129
2-[[Tert-butyl(dimethyl)silyl]oxymethyl]pent-1-en-3-ol
CID 85803710
(3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylidenepentan-1-ol
CID 101769059
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylidenepentan-1-ol
CID 101769060
(Z)-2-(diethoxymethyl)-1-trimethylsilylpent-1-en-3-ol
CID 102001456
(3R)-5-[tert-butyl(dimethyl)silyl]oxy-2-methylpent-1-en-3-ol
CID 129405780

Frequently Asked Questions

What is the IUPAC name of (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol?
The IUPAC name of (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol (CID 102001453) is (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol.
What is the SMILES notation for (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol?
The canonical SMILES for (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol is CCOCCOC/C(=C\[Si](C)(C)C)C(O)CC.
What is the InChIKey of (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol?
The InChIKey is UBFPSIDQAZGFKM-VAWYXSNFSA-N. The full InChI is InChI=1S/C13H28O3Si/c1-6-13(14)12(11-17(3,4)5)10-16-9-8-15-7-2/h11,13-14H,6-10H2,1-5H3/b12-11+.
What are the key properties of (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol?
(E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol has a molecular weight of 260.45 g/mol, XLogP of 2.61, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(2-ethoxyethoxymethyl)-1-trimethylsilylpent-1-en-3-ol is sourced from PubChem (CID 102001453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).