tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane

C14H29O2Si+ — CID 135045683

IUPACtri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane
SMILESCC(C)[Si](O[C@H]1[CH+]OCCC1)(C(C)C)C(C)C
InChIInChI=1S/C14H29O2Si/c1-11(2)17(12(3)4,13(5)6)16-14-8-7-9-15-10-14/h10-14H,7-9H2,1-6H3/q+1/t14-/m1/s1
InChIKeyVXNIOLGPTUHXJI-CQSZACIVSA-N
MW257.47 g/mol
LogP4.52
Rot. Bonds5

About tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane

tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane (PubChem CID 135045683) has the molecular formula C14H29O2Si+ and a molecular weight of 257.47 g/mol. Its IUPAC name is tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane
PubChem CID135045683
Molecular FormulaC14H29O2Si+
Molecular Weight257.47 g/mol
Exact Mass257.19
IUPAC Nametri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane
SMILESCC(C)[Si](O[C@H]1[CH+]OCCC1)(C(C)C)C(C)C
InChIInChI=1S/C14H29O2Si/c1-11(2)17(12(3)4,13(5)6)16-14-8-7-9-15-10-14/h10-14H,7-9H2,1-6H3/q+1/t14-/m1/s1
InChIKeyVXNIOLGPTUHXJI-CQSZACIVSA-N
XLogP4.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.47
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane?
The IUPAC name of tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane (CID 135045683) is tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane.
What is the SMILES notation for tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane?
The canonical SMILES for tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane is CC(C)[Si](O[C@H]1[CH+]OCCC1)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane?
The InChIKey is VXNIOLGPTUHXJI-CQSZACIVSA-N. The full InChI is InChI=1S/C14H29O2Si/c1-11(2)17(12(3)4,13(5)6)16-14-8-7-9-15-10-14/h10-14H,7-9H2,1-6H3/q+1/t14-/m1/s1.
What are the key properties of tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane?
tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane has a molecular weight of 257.47 g/mol, XLogP of 4.52, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane is sourced from PubChem (CID 135045683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).