3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane

C15H36F2O5Si3 — CID 88551639

IUPAC3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane
SMILESCO[Si](CC[Si](C)(C)O[Si](C)(C)CCCOCC(C)(F)F)(OC)OC
InChIInChI=1S/C15H36F2O5Si3/c1-15(16,17)14-21-10-9-11-23(5,6)22-24(7,8)12-13-25(18-2,19-3)20-4/h9-14H2,1-8H3
InChIKeyPYKCNJJANQJCMT-UHFFFAOYSA-N
MW418.70 g/mol
LogP4.35
Rot. Bonds14

About 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane

3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane (PubChem CID 88551639) has the molecular formula C15H36F2O5Si3 and a molecular weight of 418.70 g/mol. Its IUPAC name is 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane
PubChem CID88551639
Molecular FormulaC15H36F2O5Si3
Molecular Weight418.70 g/mol
Exact Mass418.18
IUPAC Name3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane
SMILESCO[Si](CC[Si](C)(C)O[Si](C)(C)CCCOCC(C)(F)F)(OC)OC
InChIInChI=1S/C15H36F2O5Si3/c1-15(16,17)14-21-10-9-11-23(5,6)22-24(7,8)12-13-25(18-2,19-3)20-4/h9-14H2,1-8H3
InChIKeyPYKCNJJANQJCMT-UHFFFAOYSA-N
XLogP4.35
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.70
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

tris[dimethyl(2-trimethoxysilylethyl)silyl] [3-ethoxypropyl(dimethyl)silyl] silicate
CID 59593661
[dimethyl(2-trimethoxysilylethyl)silyl]oxy-(3-fluoropropyl)-dimethylsilane
CID 176847661
3-(2-methoxyethoxy)propyl-[3-(2-methoxyethoxy)propyl-dimethylsilyl]oxy-dimethylsilane
CID 58607575
butyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane
CID 59431043
[dimethyl(3-trimethoxysilylpropyl)silyl]oxy-[[[[[[[[3-(fluoromethoxy)propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilane
CID 176847596
potassium;boranuide;3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl-dimethylsilyl]oxy-dimethylsilane
CID 139243285
[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dodecyl-dimethylsilane
CID 59027325
methane;2-methoxy-3-[3-[[2-[methoxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-dimethylsilyl]propoxy]propan-1-ol
CID 160521997
3-(3-fluoropropoxy)propyl-trimethoxysilane;fluoro(trimethoxy)methane
CID 90729153
3-(2-fluoroethoxy)propyl-trimethoxysilane;fluoro(trimethoxy)methane
CID 91274401
2-ethoxyethyl-[3-ethoxypropyl(dimethyl)silyl]oxy-dimethylsilane
CID 59964542
methane;3-(2-methoxyethoxy)propyl-dimethyl-trimethylsilyloxysilane
CID 160993525

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane?
The IUPAC name of 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane (CID 88551639) is 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane.
What is the SMILES notation for 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane?
The canonical SMILES for 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane is CO[Si](CC[Si](C)(C)O[Si](C)(C)CCCOCC(C)(F)F)(OC)OC.
What is the InChIKey of 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane?
The InChIKey is PYKCNJJANQJCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36F2O5Si3/c1-15(16,17)14-21-10-9-11-23(5,6)22-24(7,8)12-13-25(18-2,19-3)20-4/h9-14H2,1-8H3.
What are the key properties of 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane?
3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane has a molecular weight of 418.70 g/mol, XLogP of 4.35, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-difluoropropoxy)propyl-[dimethyl(2-trimethoxysilylethyl)silyl]oxy-dimethylsilane is sourced from PubChem (CID 88551639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).