tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane

C15H32O3Si — CID 159483959

IUPACtert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane
SMILESCO[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)C(C)O[C@@H]1C
InChIInChI=1S/C15H32O3Si/c1-10-11(2)17-12(3)14(16-7)13(10)18-19(8,9)15(4,5)6/h10-14H,1-9H3/t10-,11?,12+,13+,14+/m0/s1
InChIKeyAQQABEALAGQYKY-ZOGNZRORSA-N
MW288.50 g/mol
LogP3.84
Rot. Bonds3

About tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane

tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane (PubChem CID 159483959) has the molecular formula C15H32O3Si and a molecular weight of 288.50 g/mol. Its IUPAC name is tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane
PubChem CID159483959
Molecular FormulaC15H32O3Si
Molecular Weight288.50 g/mol
Exact Mass288.21
IUPAC Nametert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane
SMILESCO[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)C(C)O[C@@H]1C
InChIInChI=1S/C15H32O3Si/c1-10-11(2)17-12(3)14(16-7)13(10)18-19(8,9)15(4,5)6/h10-14H,1-9H3/t10-,11?,12+,13+,14+/m0/s1
InChIKeyAQQABEALAGQYKY-ZOGNZRORSA-N
XLogP3.84
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.50
LogP ≤ 53.84
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,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane (CID 159483959) is tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane is CO[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)C(C)O[C@@H]1C.
What is the InChIKey of tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane?
The InChIKey is AQQABEALAGQYKY-ZOGNZRORSA-N. The full InChI is InChI=1S/C15H32O3Si/c1-10-11(2)17-12(3)14(16-7)13(10)18-19(8,9)15(4,5)6/h10-14H,1-9H3/t10-,11?,12+,13+,14+/m0/s1.
What are the key properties of tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane?
tert-butyl-[(2R,3R,4R,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane has a molecular weight of 288.50 g/mol, XLogP of 3.84, 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,5S)-3-methoxy-2,5,6-trimethyloxan-4-yl]oxy-dimethylsilane is sourced from PubChem (CID 159483959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).