(2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane

C17H34O2Si — CID 173430264

IUPAC(2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane
SMILESCCCCCCCC=CCOC(C[Si](C)(C)O)=C(C)C
InChIInChI=1S/C17H34O2Si/c1-6-7-8-9-10-11-12-13-14-19-17(16(2)3)15-20(4,5)18/h12-13,18H,6-11,14-15H2,1-5H3
InChIKeySAQCHGVRBLZEPG-UHFFFAOYSA-N
MW298.54 g/mol
LogP5.41
Rot. Bonds11

About (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane

(2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane (PubChem CID 173430264) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane.

Molecular Properties

Compound Name(2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane
PubChem CID173430264
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Name(2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane
SMILESCCCCCCCC=CCOC(C[Si](C)(C)O)=C(C)C
InChIInChI=1S/C17H34O2Si/c1-6-7-8-9-10-11-12-13-14-19-17(16(2)3)15-20(4,5)18/h12-13,18H,6-11,14-15H2,1-5H3
InChIKeySAQCHGVRBLZEPG-UHFFFAOYSA-N
XLogP5.41
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 ≤ 55.41
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 (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane?
The IUPAC name of (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane (CID 173430264) is (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane.
What is the SMILES notation for (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane?
The canonical SMILES for (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane is CCCCCCCC=CCOC(C[Si](C)(C)O)=C(C)C.
What is the InChIKey of (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane?
The InChIKey is SAQCHGVRBLZEPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-6-7-8-9-10-11-12-13-14-19-17(16(2)3)15-20(4,5)18/h12-13,18H,6-11,14-15H2,1-5H3.
What are the key properties of (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane?
(2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane has a molecular weight of 298.54 g/mol, XLogP of 5.41, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-dec-2-enoxy-3-methylbut-2-enyl)-hydroxy-dimethylsilane is sourced from PubChem (CID 173430264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).