1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol

C17H34O2Si — CID 173430263

IUPAC1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol
SMILESCCCCCCCC=CCOC(O)=C(C)C[Si](C)(C)C
InChIInChI=1S/C17H34O2Si/c1-6-7-8-9-10-11-12-13-14-19-17(18)16(2)15-20(3,4)5/h12-13,18H,6-11,14-15H2,1-5H3
InChIKeyRUBFJNAJBYAUCN-UHFFFAOYSA-N
MW298.54 g/mol
LogP6.05
Rot. Bonds11

About 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol

1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol (PubChem CID 173430263) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol.

Molecular Properties

Compound Name1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol
PubChem CID173430263
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Name1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol
SMILESCCCCCCCC=CCOC(O)=C(C)C[Si](C)(C)C
InChIInChI=1S/C17H34O2Si/c1-6-7-8-9-10-11-12-13-14-19-17(18)16(2)15-20(3,4)5/h12-13,18H,6-11,14-15H2,1-5H3
InChIKeyRUBFJNAJBYAUCN-UHFFFAOYSA-N
XLogP6.05
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.54
LogP ≤ 56.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol?
The IUPAC name of 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol (CID 173430263) is 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol.
What is the SMILES notation for 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol?
The canonical SMILES for 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol is CCCCCCCC=CCOC(O)=C(C)C[Si](C)(C)C.
What is the InChIKey of 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol?
The InChIKey is RUBFJNAJBYAUCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-6-7-8-9-10-11-12-13-14-19-17(18)16(2)15-20(3,4)5/h12-13,18H,6-11,14-15H2,1-5H3.
What are the key properties of 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol?
1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol has a molecular weight of 298.54 g/mol, XLogP of 6.05, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dec-2-enoxy-2-methyl-3-trimethylsilylprop-1-en-1-ol is sourced from PubChem (CID 173430263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).