dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane

C14H6F10O2Si — CID 2769655

IUPACdimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane
SMILESCO[Si](OC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C14H6F10O2Si/c1-25-27(26-2,13-9(21)5(17)3(15)6(18)10(13)22)14-11(23)7(19)4(16)8(20)12(14)24/h1-2H3
InChIKeyOHLKTJUGGBHLLU-UHFFFAOYSA-N
MW424.27 g/mol
LogP2.93
Rot. Bonds4

About dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane

dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 2769655) has the molecular formula C14H6F10O2Si and a molecular weight of 424.27 g/mol. Its IUPAC name is dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namedimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID2769655
Molecular FormulaC14H6F10O2Si
Molecular Weight424.27 g/mol
Exact Mass424.00
IUPAC Namedimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane
SMILESCO[Si](OC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C14H6F10O2Si/c1-25-27(26-2,13-9(21)5(17)3(15)6(18)10(13)22)14-11(23)7(19)4(16)8(20)12(14)24/h1-2H3
InChIKeyOHLKTJUGGBHLLU-UHFFFAOYSA-N
XLogP2.93
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.27
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane (CID 2769655) is dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane is CO[Si](OC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is OHLKTJUGGBHLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H6F10O2Si/c1-25-27(26-2,13-9(21)5(17)3(15)6(18)10(13)22)14-11(23)7(19)4(16)8(20)12(14)24/h1-2H3.
What are the key properties of dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 424.27 g/mol, XLogP of 2.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 2769655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).