[(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate

C14H28O3Si — CID 134964945

IUPAC[(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate
SMILESCC[Si](/C=C\C(CCOC)OC(C)=O)(CC)CC
InChIInChI=1S/C14H28O3Si/c1-6-18(7-2,8-3)12-10-14(9-11-16-5)17-13(4)15/h10,12,14H,6-9,11H2,1-5H3/b12-10-
InChIKeyLVWGLNWRQWRIIZ-BENRWUELSA-N
MW272.46 g/mol
LogP3.56
Rot. Bonds9

About [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate

[(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate (PubChem CID 134964945) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate.

Molecular Properties

Compound Name[(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate
PubChem CID134964945
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Name[(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate
SMILESCC[Si](/C=C\C(CCOC)OC(C)=O)(CC)CC
InChIInChI=1S/C14H28O3Si/c1-6-18(7-2,8-3)12-10-14(9-11-16-5)17-13(4)15/h10,12,14H,6-9,11H2,1-5H3/b12-10-
InChIKeyLVWGLNWRQWRIIZ-BENRWUELSA-N
XLogP3.56
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate?
The IUPAC name of [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate (CID 134964945) is [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate.
What is the SMILES notation for [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate?
The canonical SMILES for [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate is CC[Si](/C=C\C(CCOC)OC(C)=O)(CC)CC.
What is the InChIKey of [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate?
The InChIKey is LVWGLNWRQWRIIZ-BENRWUELSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-6-18(7-2,8-3)12-10-14(9-11-16-5)17-13(4)15/h10,12,14H,6-9,11H2,1-5H3/b12-10-.
What are the key properties of [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate?
[(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate has a molecular weight of 272.46 g/mol, XLogP of 3.56, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-5-methoxy-1-triethylsilylpent-1-en-3-yl] acetate is sourced from PubChem (CID 134964945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).