methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane

C19H3F15OSi — CID 2783338

IUPACmethoxy-tris(2,3,4,5,6-pentafluorophenyl)silane
SMILESCO[Si](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C19H3F15OSi/c1-35-36(17-11(29)5(23)2(20)6(24)12(17)30,18-13(31)7(25)3(21)8(26)14(18)32)19-15(33)9(27)4(22)10(28)16(19)34/h1H3
InChIKeyZORPDMBUBHIUBO-UHFFFAOYSA-N
MW560.29 g/mol
LogP4.39
Rot. Bonds4

About methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane

methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 2783338) has the molecular formula C19H3F15OSi and a molecular weight of 560.29 g/mol. Its IUPAC name is methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namemethoxy-tris(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID2783338
Molecular FormulaC19H3F15OSi
Molecular Weight560.29 g/mol
Exact Mass559.97
IUPAC Namemethoxy-tris(2,3,4,5,6-pentafluorophenyl)silane
SMILESCO[Si](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C19H3F15OSi/c1-35-36(17-11(29)5(23)2(20)6(24)12(17)30,18-13(31)7(25)3(21)8(26)14(18)32)19-15(33)9(27)4(22)10(28)16(19)34/h1H3
InChIKeyZORPDMBUBHIUBO-UHFFFAOYSA-N
XLogP4.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500560.29
LogP ≤ 54.39
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'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane (CID 2783338) is methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane is CO[Si](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is ZORPDMBUBHIUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H3F15OSi/c1-35-36(17-11(29)5(23)2(20)6(24)12(17)30,18-13(31)7(25)3(21)8(26)14(18)32)19-15(33)9(27)4(22)10(28)16(19)34/h1H3.
What are the key properties of methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane?
methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 560.29 g/mol, XLogP of 4.39, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-tris(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 2783338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).