[3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane

C17H30O3Si — CID 58048674

IUPAC[3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane
SMILESC=CCC1(CCCC2OCCO2)C=C(O[Si](C)(C)C)CC1
InChIInChI=1S/C17H30O3Si/c1-5-9-17(10-6-7-16-18-12-13-19-16)11-8-15(14-17)20-21(2,3)4/h5,14,16H,1,6-13H2,2-4H3
InChIKeyRXQOTNFXHZYETJ-UHFFFAOYSA-N
MW310.51 g/mol
LogP4.62
Rot. Bonds8

About [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane

[3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane (PubChem CID 58048674) has the molecular formula C17H30O3Si and a molecular weight of 310.51 g/mol. Its IUPAC name is [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane
PubChem CID58048674
Molecular FormulaC17H30O3Si
Molecular Weight310.51 g/mol
Exact Mass310.20
IUPAC Name[3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane
SMILESC=CCC1(CCCC2OCCO2)C=C(O[Si](C)(C)C)CC1
InChIInChI=1S/C17H30O3Si/c1-5-9-17(10-6-7-16-18-12-13-19-16)11-8-15(14-17)20-21(2,3)4/h5,14,16H,1,6-13H2,2-4H3
InChIKeyRXQOTNFXHZYETJ-UHFFFAOYSA-N
XLogP4.62
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.51
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane?
The IUPAC name of [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane (CID 58048674) is [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane.
What is the SMILES notation for [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane?
The canonical SMILES for [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane is C=CCC1(CCCC2OCCO2)C=C(O[Si](C)(C)C)CC1.
What is the InChIKey of [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane?
The InChIKey is RXQOTNFXHZYETJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O3Si/c1-5-9-17(10-6-7-16-18-12-13-19-16)11-8-15(14-17)20-21(2,3)4/h5,14,16H,1,6-13H2,2-4H3.
What are the key properties of [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane?
[3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane has a molecular weight of 310.51 g/mol, XLogP of 4.62, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(1,3-dioxolan-2-yl)propyl]-3-prop-2-enylcyclopenten-1-yl]oxy-trimethylsilane is sourced from PubChem (CID 58048674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).