tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane

C15H28O2Si — CID 175912136

IUPACtri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane
SMILESCC(C)[Si](OCC1=CCOC=C1)(C(C)C)C(C)C
InChIInChI=1S/C15H28O2Si/c1-12(2)18(13(3)4,14(5)6)17-11-15-7-9-16-10-8-15/h7-9,12-14H,10-11H2,1-6H3
InChIKeyOMVNXECRZRACHE-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.65
Rot. Bonds6

About tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane

tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane (PubChem CID 175912136) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane.

Molecular Properties

Compound Nametri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane
PubChem CID175912136
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane
SMILESCC(C)[Si](OCC1=CCOC=C1)(C(C)C)C(C)C
InChIInChI=1S/C15H28O2Si/c1-12(2)18(13(3)4,14(5)6)17-11-15-7-9-16-10-8-15/h7-9,12-14H,10-11H2,1-6H3
InChIKeyOMVNXECRZRACHE-UHFFFAOYSA-N
XLogP4.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane?
The IUPAC name of tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane (CID 175912136) is tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane.
What is the SMILES notation for tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane?
The canonical SMILES for tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane is CC(C)[Si](OCC1=CCOC=C1)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane?
The InChIKey is OMVNXECRZRACHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-12(2)18(13(3)4,14(5)6)17-11-15-7-9-16-10-8-15/h7-9,12-14H,10-11H2,1-6H3.
What are the key properties of tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane?
tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane has a molecular weight of 268.47 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-(2H-pyran-4-ylmethoxy)silane is sourced from PubChem (CID 175912136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).