tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane

C11H22Br2OSi — CID 10428447

IUPACtert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane
SMILESC[C@H](C=C(Br)Br)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22Br2OSi/c1-9(7-10(12)13)8-14-15(5,6)11(2,3)4/h7,9H,8H2,1-6H3/t9-/m1/s1
InChIKeyNZQJJNXKDABHFQ-SECBINFHSA-N
MW358.19 g/mol
LogP5.28
Rot. Bonds4

About tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane

tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane (PubChem CID 10428447) has the molecular formula C11H22Br2OSi and a molecular weight of 358.19 g/mol. Its IUPAC name is tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane
PubChem CID10428447
Molecular FormulaC11H22Br2OSi
Molecular Weight358.19 g/mol
Exact Mass355.98
IUPAC Nametert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane
SMILESC[C@H](C=C(Br)Br)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22Br2OSi/c1-9(7-10(12)13)8-14-15(5,6)11(2,3)4/h7,9H,8H2,1-6H3/t9-/m1/s1
InChIKeyNZQJJNXKDABHFQ-SECBINFHSA-N
XLogP5.28
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.19
LogP ≤ 55.28
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 tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane (CID 10428447) is tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane is C[C@H](C=C(Br)Br)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane?
The InChIKey is NZQJJNXKDABHFQ-SECBINFHSA-N. The full InChI is InChI=1S/C11H22Br2OSi/c1-9(7-10(12)13)8-14-15(5,6)11(2,3)4/h7,9H,8H2,1-6H3/t9-/m1/s1.
What are the key properties of tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane?
tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane has a molecular weight of 358.19 g/mol, XLogP of 5.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-4,4-dibromo-2-methylbut-3-enoxy]-dimethylsilane is sourced from PubChem (CID 10428447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).