[(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane

C11H21BrOSi — CID 10880391

IUPAC[(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)O[C@H]1CC=C(Br)C1
InChIInChI=1S/C11H21BrOSi/c1-11(2,3)14(4,5)13-10-7-6-9(12)8-10/h6,10H,7-8H2,1-5H3/t10-/m0/s1
InChIKeyZBKKGXZRIWTBFS-JTQLQIEISA-N
MW277.28 g/mol
LogP4.45
Rot. Bonds2

About [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane

[(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane (PubChem CID 10880391) has the molecular formula C11H21BrOSi and a molecular weight of 277.28 g/mol. Its IUPAC name is [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane
PubChem CID10880391
Molecular FormulaC11H21BrOSi
Molecular Weight277.28 g/mol
Exact Mass276.05
IUPAC Name[(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)O[C@H]1CC=C(Br)C1
InChIInChI=1S/C11H21BrOSi/c1-11(2,3)14(4,5)13-10-7-6-9(12)8-10/h6,10H,7-8H2,1-5H3/t10-/m0/s1
InChIKeyZBKKGXZRIWTBFS-JTQLQIEISA-N
XLogP4.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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[3-(4-bromophenoxy)cyclobutyl]oxy-tert-butyl-dimethylsilane
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tert-butyl-[(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)oxy]-dimethylsilane
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CID 58666151
[(6R,8R,8aS)-6-[tert-butyl(dimethyl)silyl]oxy-3,5,6,7,8,8a-hexahydro-1H-isochromen-8-yl]oxy-tert-butyl-dimethylsilane
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tert-butyl-(5-chloro-4-pyrrolidin-1-ylcyclohex-3-en-1-yl)oxy-dimethylsilane
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Frequently Asked Questions

What is the IUPAC name of [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane?
The IUPAC name of [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane (CID 10880391) is [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane?
The canonical SMILES for [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)O[C@H]1CC=C(Br)C1.
What is the InChIKey of [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane?
The InChIKey is ZBKKGXZRIWTBFS-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21BrOSi/c1-11(2,3)14(4,5)13-10-7-6-9(12)8-10/h6,10H,7-8H2,1-5H3/t10-/m0/s1.
What are the key properties of [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane?
[(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane has a molecular weight of 277.28 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-3-bromocyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 10880391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).