but-3-enoxy-dimethoxy-prop-2-enylsilane

C9H18O3Si — CID 87123332

IUPACbut-3-enoxy-dimethoxy-prop-2-enylsilane
SMILESC=CCCO[Si](CC=C)(OC)OC
InChIInChI=1S/C9H18O3Si/c1-5-7-8-12-13(10-3,11-4)9-6-2/h5-6H,1-2,7-9H2,3-4H3
InChIKeyKAYMIDFEYIPZFC-UHFFFAOYSA-N
MW202.33 g/mol
LogP2.00
Rot. Bonds8

About but-3-enoxy-dimethoxy-prop-2-enylsilane

but-3-enoxy-dimethoxy-prop-2-enylsilane (PubChem CID 87123332) has the molecular formula C9H18O3Si and a molecular weight of 202.33 g/mol. Its IUPAC name is but-3-enoxy-dimethoxy-prop-2-enylsilane.

Molecular Properties

Compound Namebut-3-enoxy-dimethoxy-prop-2-enylsilane
PubChem CID87123332
Molecular FormulaC9H18O3Si
Molecular Weight202.33 g/mol
Exact Mass202.10
IUPAC Namebut-3-enoxy-dimethoxy-prop-2-enylsilane
SMILESC=CCCO[Si](CC=C)(OC)OC
InChIInChI=1S/C9H18O3Si/c1-5-7-8-12-13(10-3,11-4)9-6-2/h5-6H,1-2,7-9H2,3-4H3
InChIKeyKAYMIDFEYIPZFC-UHFFFAOYSA-N
XLogP2.00
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.33
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 but-3-enoxy-dimethoxy-prop-2-enylsilane?
The IUPAC name of but-3-enoxy-dimethoxy-prop-2-enylsilane (CID 87123332) is but-3-enoxy-dimethoxy-prop-2-enylsilane.
What is the SMILES notation for but-3-enoxy-dimethoxy-prop-2-enylsilane?
The canonical SMILES for but-3-enoxy-dimethoxy-prop-2-enylsilane is C=CCCO[Si](CC=C)(OC)OC.
What is the InChIKey of but-3-enoxy-dimethoxy-prop-2-enylsilane?
The InChIKey is KAYMIDFEYIPZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O3Si/c1-5-7-8-12-13(10-3,11-4)9-6-2/h5-6H,1-2,7-9H2,3-4H3.
What are the key properties of but-3-enoxy-dimethoxy-prop-2-enylsilane?
but-3-enoxy-dimethoxy-prop-2-enylsilane has a molecular weight of 202.33 g/mol, XLogP of 2.00, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enoxy-dimethoxy-prop-2-enylsilane is sourced from PubChem (CID 87123332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).