(4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane

C8H14Br2OSi — CID 175260563

IUPAC(4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane
SMILESC[SiH](C)OC1CC=C(Br)C(Br)C1
InChIInChI=1S/C8H14Br2OSi/c1-12(2)11-6-3-4-7(9)8(10)5-6/h4,6,8,12H,3,5H2,1-2H3
InChIKeyWMXFETHFJGMKIV-UHFFFAOYSA-N
MW314.09 g/mol
LogP3.19
Rot. Bonds2

About (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane

(4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane (PubChem CID 175260563) has the molecular formula C8H14Br2OSi and a molecular weight of 314.09 g/mol. Its IUPAC name is (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane.

Molecular Properties

Compound Name(4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane
PubChem CID175260563
Molecular FormulaC8H14Br2OSi
Molecular Weight314.09 g/mol
Exact Mass311.92
IUPAC Name(4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane
SMILESC[SiH](C)OC1CC=C(Br)C(Br)C1
InChIInChI=1S/C8H14Br2OSi/c1-12(2)11-6-3-4-7(9)8(10)5-6/h4,6,8,12H,3,5H2,1-2H3
InChIKeyWMXFETHFJGMKIV-UHFFFAOYSA-N
XLogP3.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.09
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane?
The IUPAC name of (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane (CID 175260563) is (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane.
What is the SMILES notation for (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane?
The canonical SMILES for (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane is C[SiH](C)OC1CC=C(Br)C(Br)C1.
What is the InChIKey of (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane?
The InChIKey is WMXFETHFJGMKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14Br2OSi/c1-12(2)11-6-3-4-7(9)8(10)5-6/h4,6,8,12H,3,5H2,1-2H3.
What are the key properties of (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane?
(4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane has a molecular weight of 314.09 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5-dibromocyclohex-3-en-1-yl)oxy-dimethylsilane is sourced from PubChem (CID 175260563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).