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

C17H36OSi — CID 10424041

IUPAC(E,3S)-1-triethylsilylundec-1-en-3-ol
SMILESCCCCCCCC[C@H](O)/C=C/[Si](CC)(CC)CC
InChIInChI=1S/C17H36OSi/c1-5-9-10-11-12-13-14-17(18)15-16-19(6-2,7-3)8-4/h15-18H,5-14H2,1-4H3/b16-15+/t17-/m0/s1
InChIKeySBUQYAAZOJKMAB-IWLLYFRBSA-N
MW284.56 g/mol
LogP5.70
Rot. Bonds12

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

(E,3S)-1-triethylsilylundec-1-en-3-ol (PubChem CID 10424041) has the molecular formula C17H36OSi and a molecular weight of 284.56 g/mol. Its IUPAC name is (E,3S)-1-triethylsilylundec-1-en-3-ol.

Molecular Properties

Compound Name(E,3S)-1-triethylsilylundec-1-en-3-ol
PubChem CID10424041
Molecular FormulaC17H36OSi
Molecular Weight284.56 g/mol
Exact Mass284.25
IUPAC Name(E,3S)-1-triethylsilylundec-1-en-3-ol
SMILESCCCCCCCC[C@H](O)/C=C/[Si](CC)(CC)CC
InChIInChI=1S/C17H36OSi/c1-5-9-10-11-12-13-14-17(18)15-16-19(6-2,7-3)8-4/h15-18H,5-14H2,1-4H3/b16-15+/t17-/m0/s1
InChIKeySBUQYAAZOJKMAB-IWLLYFRBSA-N
XLogP5.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.56
LogP ≤ 55.70
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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Frequently Asked Questions

What is the IUPAC name of (E,3S)-1-triethylsilylundec-1-en-3-ol?
The IUPAC name of (E,3S)-1-triethylsilylundec-1-en-3-ol (CID 10424041) is (E,3S)-1-triethylsilylundec-1-en-3-ol.
What is the SMILES notation for (E,3S)-1-triethylsilylundec-1-en-3-ol?
The canonical SMILES for (E,3S)-1-triethylsilylundec-1-en-3-ol is CCCCCCCC[C@H](O)/C=C/[Si](CC)(CC)CC.
What is the InChIKey of (E,3S)-1-triethylsilylundec-1-en-3-ol?
The InChIKey is SBUQYAAZOJKMAB-IWLLYFRBSA-N. The full InChI is InChI=1S/C17H36OSi/c1-5-9-10-11-12-13-14-17(18)15-16-19(6-2,7-3)8-4/h15-18H,5-14H2,1-4H3/b16-15+/t17-/m0/s1.
What are the key properties of (E,3S)-1-triethylsilylundec-1-en-3-ol?
(E,3S)-1-triethylsilylundec-1-en-3-ol has a molecular weight of 284.56 g/mol, XLogP of 5.70, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,3S)-1-triethylsilylundec-1-en-3-ol is sourced from PubChem (CID 10424041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).