[(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane

C8H17BrOSi — CID 11791214

IUPAC[(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane
SMILESCC(C)/C(Br)=C/O[Si](C)(C)C
InChIInChI=1S/C8H17BrOSi/c1-7(2)8(9)6-10-11(3,4)5/h6-7H,1-5H3/b8-6-
InChIKeyHITIBKXODWCRGB-VURMDHGXSA-N
MW237.21 g/mol
LogP3.73
Rot. Bonds3

About [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane

[(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane (PubChem CID 11791214) has the molecular formula C8H17BrOSi and a molecular weight of 237.21 g/mol. Its IUPAC name is [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane
PubChem CID11791214
Molecular FormulaC8H17BrOSi
Molecular Weight237.21 g/mol
Exact Mass236.02
IUPAC Name[(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane
SMILESCC(C)/C(Br)=C/O[Si](C)(C)C
InChIInChI=1S/C8H17BrOSi/c1-7(2)8(9)6-10-11(3,4)5/h6-7H,1-5H3/b8-6-
InChIKeyHITIBKXODWCRGB-VURMDHGXSA-N
XLogP3.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.21
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane?
The IUPAC name of [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane (CID 11791214) is [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane.
What is the SMILES notation for [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane?
The canonical SMILES for [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane is CC(C)/C(Br)=C/O[Si](C)(C)C.
What is the InChIKey of [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane?
The InChIKey is HITIBKXODWCRGB-VURMDHGXSA-N. The full InChI is InChI=1S/C8H17BrOSi/c1-7(2)8(9)6-10-11(3,4)5/h6-7H,1-5H3/b8-6-.
What are the key properties of [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane?
[(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane has a molecular weight of 237.21 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-bromo-3-methylbut-1-enoxy]-trimethylsilane is sourced from PubChem (CID 11791214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).