(3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane

C12H18F2O2Si — CID 91730362

IUPAC(3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane
SMILESCC(C)CO[Si](C)(C)Oc1cc(F)cc(F)c1
InChIInChI=1S/C12H18F2O2Si/c1-9(2)8-15-17(3,4)16-12-6-10(13)5-11(14)7-12/h5-7,9H,8H2,1-4H3
InChIKeySWEVWFXHEFUOOY-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.72
Rot. Bonds5

About (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane

(3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane (PubChem CID 91730362) has the molecular formula C12H18F2O2Si and a molecular weight of 260.36 g/mol. Its IUPAC name is (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane.

Molecular Properties

Compound Name(3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane
PubChem CID91730362
Molecular FormulaC12H18F2O2Si
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name(3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane
SMILESCC(C)CO[Si](C)(C)Oc1cc(F)cc(F)c1
InChIInChI=1S/C12H18F2O2Si/c1-9(2)8-15-17(3,4)16-12-6-10(13)5-11(14)7-12/h5-7,9H,8H2,1-4H3
InChIKeySWEVWFXHEFUOOY-UHFFFAOYSA-N
XLogP3.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.72
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 (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane?
The IUPAC name of (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane (CID 91730362) is (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane.
What is the SMILES notation for (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane?
The canonical SMILES for (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane is CC(C)CO[Si](C)(C)Oc1cc(F)cc(F)c1.
What is the InChIKey of (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane?
The InChIKey is SWEVWFXHEFUOOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18F2O2Si/c1-9(2)8-15-17(3,4)16-12-6-10(13)5-11(14)7-12/h5-7,9H,8H2,1-4H3.
What are the key properties of (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane?
(3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane has a molecular weight of 260.36 g/mol, XLogP of 3.72, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluorophenoxy)-dimethyl-(2-methylpropoxy)silane is sourced from PubChem (CID 91730362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).