3-bromobut-3-enoxy(triethyl)silane

C10H21BrOSi — CID 86051369

IUPAC3-bromobut-3-enoxy(triethyl)silane
SMILESC=C(Br)CCO[Si](CC)(CC)CC
InChIInChI=1S/C10H21BrOSi/c1-5-13(6-2,7-3)12-9-8-10(4)11/h4-9H2,1-3H3
InChIKeyHGJPAXOAKDCIJL-UHFFFAOYSA-N
MW265.27 g/mol
LogP4.31
Rot. Bonds7

About 3-bromobut-3-enoxy(triethyl)silane

3-bromobut-3-enoxy(triethyl)silane (PubChem CID 86051369) has the molecular formula C10H21BrOSi and a molecular weight of 265.27 g/mol. Its IUPAC name is 3-bromobut-3-enoxy(triethyl)silane.

Molecular Properties

Compound Name3-bromobut-3-enoxy(triethyl)silane
PubChem CID86051369
Molecular FormulaC10H21BrOSi
Molecular Weight265.27 g/mol
Exact Mass264.05
IUPAC Name3-bromobut-3-enoxy(triethyl)silane
SMILESC=C(Br)CCO[Si](CC)(CC)CC
InChIInChI=1S/C10H21BrOSi/c1-5-13(6-2,7-3)12-9-8-10(4)11/h4-9H2,1-3H3
InChIKeyHGJPAXOAKDCIJL-UHFFFAOYSA-N
XLogP4.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 3-bromobut-3-enoxy(triethyl)silane?
The IUPAC name of 3-bromobut-3-enoxy(triethyl)silane (CID 86051369) is 3-bromobut-3-enoxy(triethyl)silane.
What is the SMILES notation for 3-bromobut-3-enoxy(triethyl)silane?
The canonical SMILES for 3-bromobut-3-enoxy(triethyl)silane is C=C(Br)CCO[Si](CC)(CC)CC.
What is the InChIKey of 3-bromobut-3-enoxy(triethyl)silane?
The InChIKey is HGJPAXOAKDCIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21BrOSi/c1-5-13(6-2,7-3)12-9-8-10(4)11/h4-9H2,1-3H3.
What are the key properties of 3-bromobut-3-enoxy(triethyl)silane?
3-bromobut-3-enoxy(triethyl)silane has a molecular weight of 265.27 g/mol, XLogP of 4.31, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromobut-3-enoxy(triethyl)silane is sourced from PubChem (CID 86051369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).