trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane

C13H26O2Si — CID 139660799

IUPACtrimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane
SMILESCCCCCC1CC=CC(O[Si](C)(C)C)O1
InChIInChI=1S/C13H26O2Si/c1-5-6-7-9-12-10-8-11-13(14-12)15-16(2,3)4/h8,11-13H,5-7,9-10H2,1-4H3
InChIKeyGBXPLEMGFKJVPB-UHFFFAOYSA-N
MW242.43 g/mol
LogP4.09
Rot. Bonds6

About trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane

trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane (PubChem CID 139660799) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane.

Molecular Properties

Compound Nametrimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane
PubChem CID139660799
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Nametrimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane
SMILESCCCCCC1CC=CC(O[Si](C)(C)C)O1
InChIInChI=1S/C13H26O2Si/c1-5-6-7-9-12-10-8-11-13(14-12)15-16(2,3)4/h8,11-13H,5-7,9-10H2,1-4H3
InChIKeyGBXPLEMGFKJVPB-UHFFFAOYSA-N
XLogP4.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane?
The IUPAC name of trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane (CID 139660799) is trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane.
What is the SMILES notation for trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane?
The canonical SMILES for trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane is CCCCCC1CC=CC(O[Si](C)(C)C)O1.
What is the InChIKey of trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane?
The InChIKey is GBXPLEMGFKJVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-5-6-7-9-12-10-8-11-13(14-12)15-16(2,3)4/h8,11-13H,5-7,9-10H2,1-4H3.
What are the key properties of trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane?
trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane has a molecular weight of 242.43 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2-pentyl-3,6-dihydro-2H-pyran-6-yl)oxy]silane is sourced from PubChem (CID 139660799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).