but-3-enoxy(oxan-2-yl)silane

C9H18O2Si — CID 123472347

IUPACbut-3-enoxy(oxan-2-yl)silane
SMILESC=CCCO[SiH2]C1CCCCO1
InChIInChI=1S/C9H18O2Si/c1-2-3-8-11-12-9-6-4-5-7-10-9/h2,9H,1,3-8,12H2
InChIKeyBEGUZWRHRKNTQV-UHFFFAOYSA-N
MW186.33 g/mol
LogP1.19
Rot. Bonds5

About but-3-enoxy(oxan-2-yl)silane

but-3-enoxy(oxan-2-yl)silane (PubChem CID 123472347) has the molecular formula C9H18O2Si and a molecular weight of 186.33 g/mol. Its IUPAC name is but-3-enoxy(oxan-2-yl)silane.

Molecular Properties

Compound Namebut-3-enoxy(oxan-2-yl)silane
PubChem CID123472347
Molecular FormulaC9H18O2Si
Molecular Weight186.33 g/mol
Exact Mass186.11
IUPAC Namebut-3-enoxy(oxan-2-yl)silane
SMILESC=CCCO[SiH2]C1CCCCO1
InChIInChI=1S/C9H18O2Si/c1-2-3-8-11-12-9-6-4-5-7-10-9/h2,9H,1,3-8,12H2
InChIKeyBEGUZWRHRKNTQV-UHFFFAOYSA-N
XLogP1.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.33
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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(oxan-2-yl)silane?
The IUPAC name of but-3-enoxy(oxan-2-yl)silane (CID 123472347) is but-3-enoxy(oxan-2-yl)silane.
What is the SMILES notation for but-3-enoxy(oxan-2-yl)silane?
The canonical SMILES for but-3-enoxy(oxan-2-yl)silane is C=CCCO[SiH2]C1CCCCO1.
What is the InChIKey of but-3-enoxy(oxan-2-yl)silane?
The InChIKey is BEGUZWRHRKNTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2Si/c1-2-3-8-11-12-9-6-4-5-7-10-9/h2,9H,1,3-8,12H2.
What are the key properties of but-3-enoxy(oxan-2-yl)silane?
but-3-enoxy(oxan-2-yl)silane has a molecular weight of 186.33 g/mol, XLogP of 1.19, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enoxy(oxan-2-yl)silane is sourced from PubChem (CID 123472347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).