fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane

C12H31FO7Si3 — CID 162454247

IUPACfluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane
SMILESCO[Si](CCC[Si](O)(F)CCC[Si](OC)(OC)OC)(OC)OC
InChIInChI=1S/C12H31FO7Si3/c1-15-22(16-2,17-3)11-7-9-21(13,14)10-8-12-23(18-4,19-5)20-6/h14H,7-12H2,1-6H3
InChIKeyNAIDDNHRGSFVHD-UHFFFAOYSA-N
MW390.63 g/mol
LogP1.93
Rot. Bonds14

About fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane

fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane (PubChem CID 162454247) has the molecular formula C12H31FO7Si3 and a molecular weight of 390.63 g/mol. Its IUPAC name is fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane.

Molecular Properties

Compound Namefluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane
PubChem CID162454247
Molecular FormulaC12H31FO7Si3
Molecular Weight390.63 g/mol
Exact Mass390.14
IUPAC Namefluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane
SMILESCO[Si](CCC[Si](O)(F)CCC[Si](OC)(OC)OC)(OC)OC
InChIInChI=1S/C12H31FO7Si3/c1-15-22(16-2,17-3)11-7-9-21(13,14)10-8-12-23(18-4,19-5)20-6/h14H,7-12H2,1-6H3
InChIKeyNAIDDNHRGSFVHD-UHFFFAOYSA-N
XLogP1.93
TPSA75.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.63
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane?
The IUPAC name of fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane (CID 162454247) is fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane.
What is the SMILES notation for fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane?
The canonical SMILES for fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane is CO[Si](CCC[Si](O)(F)CCC[Si](OC)(OC)OC)(OC)OC.
What is the InChIKey of fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane?
The InChIKey is NAIDDNHRGSFVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H31FO7Si3/c1-15-22(16-2,17-3)11-7-9-21(13,14)10-8-12-23(18-4,19-5)20-6/h14H,7-12H2,1-6H3.
What are the key properties of fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane?
fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane has a molecular weight of 390.63 g/mol, XLogP of 1.93, 14 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-hydroxy-bis(3-trimethoxysilylpropyl)silane is sourced from PubChem (CID 162454247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).