(4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol

C12H24O4Si — CID 10730088

IUPAC(4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol
SMILESC=C[C@H]1OC(O)C[C@@H](O)[C@H]1OCC[Si](C)(C)C
InChIInChI=1S/C12H24O4Si/c1-5-10-12(9(13)8-11(14)16-10)15-6-7-17(2,3)4/h5,9-14H,1,6-8H2,2-4H3/t9-,10-,11?,12-/m1/s1
InChIKeyFAKBBIPUHPOHGY-MAPNCKNWSA-N
MW260.41 g/mol
LogP1.36
Rot. Bonds5

About (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol

(4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol (PubChem CID 10730088) has the molecular formula C12H24O4Si and a molecular weight of 260.41 g/mol. Its IUPAC name is (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol.

Molecular Properties

Compound Name(4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol
PubChem CID10730088
Molecular FormulaC12H24O4Si
Molecular Weight260.41 g/mol
Exact Mass260.14
IUPAC Name(4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol
SMILESC=C[C@H]1OC(O)C[C@@H](O)[C@H]1OCC[Si](C)(C)C
InChIInChI=1S/C12H24O4Si/c1-5-10-12(9(13)8-11(14)16-10)15-6-7-17(2,3)4/h5,9-14H,1,6-8H2,2-4H3/t9-,10-,11?,12-/m1/s1
InChIKeyFAKBBIPUHPOHGY-MAPNCKNWSA-N
XLogP1.36
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol?
The IUPAC name of (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol (CID 10730088) is (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol.
What is the SMILES notation for (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol?
The canonical SMILES for (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol is C=C[C@H]1OC(O)C[C@@H](O)[C@H]1OCC[Si](C)(C)C.
What is the InChIKey of (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol?
The InChIKey is FAKBBIPUHPOHGY-MAPNCKNWSA-N. The full InChI is InChI=1S/C12H24O4Si/c1-5-10-12(9(13)8-11(14)16-10)15-6-7-17(2,3)4/h5,9-14H,1,6-8H2,2-4H3/t9-,10-,11?,12-/m1/s1.
What are the key properties of (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol?
(4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol has a molecular weight of 260.41 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R,6R)-6-ethenyl-5-(2-trimethylsilylethoxy)oxane-2,4-diol is sourced from PubChem (CID 10730088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).