3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane

C11H28F2O3Si3 — CID 87849284

IUPAC3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane
SMILESCO[Si](C)(CCC(C)(F)F)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C11H28F2O3Si3/c1-11(12,13)9-10-19(8,14-2)16-18(6,7)15-17(3,4)5/h9-10H2,1-8H3
InChIKeyBECVPDLDSCOBRP-UHFFFAOYSA-N
MW330.60 g/mol
LogP4.32
Rot. Bonds8

About 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane

3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane (PubChem CID 87849284) has the molecular formula C11H28F2O3Si3 and a molecular weight of 330.60 g/mol. Its IUPAC name is 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane.

Molecular Properties

Compound Name3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane
PubChem CID87849284
Molecular FormulaC11H28F2O3Si3
Molecular Weight330.60 g/mol
Exact Mass330.13
IUPAC Name3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane
SMILESCO[Si](C)(CCC(C)(F)F)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C11H28F2O3Si3/c1-11(12,13)9-10-19(8,14-2)16-18(6,7)15-17(3,4)5/h9-10H2,1-8H3
InChIKeyBECVPDLDSCOBRP-UHFFFAOYSA-N
XLogP4.32
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.60
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane?
The IUPAC name of 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane (CID 87849284) is 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane.
What is the SMILES notation for 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane?
The canonical SMILES for 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane is CO[Si](C)(CCC(C)(F)F)O[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane?
The InChIKey is BECVPDLDSCOBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28F2O3Si3/c1-11(12,13)9-10-19(8,14-2)16-18(6,7)15-17(3,4)5/h9-10H2,1-8H3.
What are the key properties of 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane?
3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane has a molecular weight of 330.60 g/mol, XLogP of 4.32, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluorobutyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methoxy-methylsilane is sourced from PubChem (CID 87849284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).