trimethyl(1-phenylpropoxy)silane

C12H20OSi — CID 530376

IUPACtrimethyl(1-phenylpropoxy)silane
SMILESCCC(O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C12H20OSi/c1-5-12(13-14(2,3)4)11-9-7-6-8-10-11/h6-10,12H,5H2,1-4H3
InChIKeyYLXOSLUBLGUGQW-UHFFFAOYSA-N
MW208.38 g/mol
LogP3.99
Rot. Bonds4

About trimethyl(1-phenylpropoxy)silane

trimethyl(1-phenylpropoxy)silane (PubChem CID 530376) has the molecular formula C12H20OSi and a molecular weight of 208.38 g/mol. Its IUPAC name is trimethyl(1-phenylpropoxy)silane.

Molecular Properties

Compound Nametrimethyl(1-phenylpropoxy)silane
PubChem CID530376
Molecular FormulaC12H20OSi
Molecular Weight208.38 g/mol
Exact Mass208.13
IUPAC Nametrimethyl(1-phenylpropoxy)silane
SMILESCCC(O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C12H20OSi/c1-5-12(13-14(2,3)4)11-9-7-6-8-10-11/h6-10,12H,5H2,1-4H3
InChIKeyYLXOSLUBLGUGQW-UHFFFAOYSA-N
XLogP3.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.38
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 trimethyl(1-phenylpropoxy)silane?
The IUPAC name of trimethyl(1-phenylpropoxy)silane (CID 530376) is trimethyl(1-phenylpropoxy)silane.
What is the SMILES notation for trimethyl(1-phenylpropoxy)silane?
The canonical SMILES for trimethyl(1-phenylpropoxy)silane is CCC(O[Si](C)(C)C)c1ccccc1.
What is the InChIKey of trimethyl(1-phenylpropoxy)silane?
The InChIKey is YLXOSLUBLGUGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OSi/c1-5-12(13-14(2,3)4)11-9-7-6-8-10-11/h6-10,12H,5H2,1-4H3.
What are the key properties of trimethyl(1-phenylpropoxy)silane?
trimethyl(1-phenylpropoxy)silane has a molecular weight of 208.38 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(1-phenylpropoxy)silane is sourced from PubChem (CID 530376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).