dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane

C11H15F3O3Si — CID 90170275

IUPACdimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane
SMILESCO[Si](OC)(OC(C)C)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C11H15F3O3Si/c1-7(2)17-18(15-3,16-4)8-5-9(12)11(14)10(13)6-8/h5-7H,1-4H3
InChIKeyOZAVPWMTDKHLHN-UHFFFAOYSA-N
MW280.32 g/mol
LogP1.97
Rot. Bonds5

About dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane

dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane (PubChem CID 90170275) has the molecular formula C11H15F3O3Si and a molecular weight of 280.32 g/mol. Its IUPAC name is dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane.

Molecular Properties

Compound Namedimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane
PubChem CID90170275
Molecular FormulaC11H15F3O3Si
Molecular Weight280.32 g/mol
Exact Mass280.07
IUPAC Namedimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane
SMILESCO[Si](OC)(OC(C)C)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C11H15F3O3Si/c1-7(2)17-18(15-3,16-4)8-5-9(12)11(14)10(13)6-8/h5-7H,1-4H3
InChIKeyOZAVPWMTDKHLHN-UHFFFAOYSA-N
XLogP1.97
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane?
The IUPAC name of dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane (CID 90170275) is dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane.
What is the SMILES notation for dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane?
The canonical SMILES for dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane is CO[Si](OC)(OC(C)C)c1cc(F)c(F)c(F)c1.
What is the InChIKey of dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane?
The InChIKey is OZAVPWMTDKHLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3O3Si/c1-7(2)17-18(15-3,16-4)8-5-9(12)11(14)10(13)6-8/h5-7H,1-4H3.
What are the key properties of dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane?
dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane has a molecular weight of 280.32 g/mol, XLogP of 1.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-propan-2-yloxy-(3,4,5-trifluorophenyl)silane is sourced from PubChem (CID 90170275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).