tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane

C13H26O3Si — CID 159483958

IUPACtert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane
SMILESCO[C@@H]1[C@@H](C)OC=C[C@H]1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O3Si/c1-10-12(14-5)11(8-9-15-10)16-17(6,7)13(2,3)4/h8-12H,1-7H3/t10-,11-,12-/m1/s1
InChIKeyUOXGXWZTRLPBDP-IJLUTSLNSA-N
MW258.43 g/mol
LogP3.32
Rot. Bonds3

About tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane

tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane (PubChem CID 159483958) has the molecular formula C13H26O3Si and a molecular weight of 258.43 g/mol. Its IUPAC name is tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane
PubChem CID159483958
Molecular FormulaC13H26O3Si
Molecular Weight258.43 g/mol
Exact Mass258.17
IUPAC Nametert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane
SMILESCO[C@@H]1[C@@H](C)OC=C[C@H]1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O3Si/c1-10-12(14-5)11(8-9-15-10)16-17(6,7)13(2,3)4/h8-12H,1-7H3/t10-,11-,12-/m1/s1
InChIKeyUOXGXWZTRLPBDP-IJLUTSLNSA-N
XLogP3.32
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane (CID 159483958) is tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane is CO[C@@H]1[C@@H](C)OC=C[C@H]1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane?
The InChIKey is UOXGXWZTRLPBDP-IJLUTSLNSA-N. The full InChI is InChI=1S/C13H26O3Si/c1-10-12(14-5)11(8-9-15-10)16-17(6,7)13(2,3)4/h8-12H,1-7H3/t10-,11-,12-/m1/s1.
What are the key properties of tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane?
tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane has a molecular weight of 258.43 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2R,3R,4R)-3-methoxy-2-methyl-3,4-dihydro-2H-pyran-4-yl]oxy]-dimethylsilane is sourced from PubChem (CID 159483958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).