dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane

C11H13F5OSi — CID 523425

IUPACdimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane
SMILESCCCO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C11H13F5OSi/c1-4-5-17-18(2,3)11-9(15)7(13)6(12)8(14)10(11)16/h4-5H2,1-3H3
InChIKeyGILOEPIHADKBNZ-UHFFFAOYSA-N
MW284.30 g/mol
LogP3.22
Rot. Bonds4

About dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane

dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane (PubChem CID 523425) has the molecular formula C11H13F5OSi and a molecular weight of 284.30 g/mol. Its IUPAC name is dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane.

Molecular Properties

Compound Namedimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane
PubChem CID523425
Molecular FormulaC11H13F5OSi
Molecular Weight284.30 g/mol
Exact Mass284.07
IUPAC Namedimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane
SMILESCCCO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C11H13F5OSi/c1-4-5-17-18(2,3)11-9(15)7(13)6(12)8(14)10(11)16/h4-5H2,1-3H3
InChIKeyGILOEPIHADKBNZ-UHFFFAOYSA-N
XLogP3.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.30
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'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 dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane?
The IUPAC name of dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane (CID 523425) is dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane.
What is the SMILES notation for dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane?
The canonical SMILES for dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane is CCCO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane?
The InChIKey is GILOEPIHADKBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F5OSi/c1-4-5-17-18(2,3)11-9(15)7(13)6(12)8(14)10(11)16/h4-5H2,1-3H3.
What are the key properties of dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane?
dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane has a molecular weight of 284.30 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2,3,4,5,6-pentafluorophenyl)-propoxysilane is sourced from PubChem (CID 523425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).