trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane

C15H28O2Si — CID 101266058

IUPACtrimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane
SMILESC=C(C[C@H]1CC(C)O[C@@H](/C=C/C)O1)C[Si](C)(C)C
InChIInChI=1S/C15H28O2Si/c1-7-8-15-16-13(3)10-14(17-15)9-12(2)11-18(4,5)6/h7-8,13-15H,2,9-11H2,1,3-6H3/b8-7+/t13?,14-,15+/m0/s1
InChIKeyNVFRZCPLPKNKHY-QEOKUOKVSA-N
MW268.47 g/mol
LogP4.37
Rot. Bonds5

About trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane

trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane (PubChem CID 101266058) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane
PubChem CID101266058
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametrimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane
SMILESC=C(C[C@H]1CC(C)O[C@@H](/C=C/C)O1)C[Si](C)(C)C
InChIInChI=1S/C15H28O2Si/c1-7-8-15-16-13(3)10-14(17-15)9-12(2)11-18(4,5)6/h7-8,13-15H,2,9-11H2,1,3-6H3/b8-7+/t13?,14-,15+/m0/s1
InChIKeyNVFRZCPLPKNKHY-QEOKUOKVSA-N
XLogP4.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane?
The IUPAC name of trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane (CID 101266058) is trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane.
What is the SMILES notation for trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane?
The canonical SMILES for trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane is C=C(C[C@H]1CC(C)O[C@@H](/C=C/C)O1)C[Si](C)(C)C.
What is the InChIKey of trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane?
The InChIKey is NVFRZCPLPKNKHY-QEOKUOKVSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-7-8-15-16-13(3)10-14(17-15)9-12(2)11-18(4,5)6/h7-8,13-15H,2,9-11H2,1,3-6H3/b8-7+/t13?,14-,15+/m0/s1.
What are the key properties of trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane?
trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane has a molecular weight of 268.47 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[(2R,4S)-6-methyl-2-[(E)-prop-1-enyl]-1,3-dioxan-4-yl]methyl]prop-2-enyl]silane is sourced from PubChem (CID 101266058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).