[dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane

C9H23F3O4Si3 — CID 155603003

IUPAC[dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane
SMILESCO[Si](C)(OC)O[Si](C)(CCC(F)(F)F)O[SiH](C)C
InChIInChI=1S/C9H23F3O4Si3/c1-13-19(6,14-2)16-18(5,15-17(3)4)8-7-9(10,11)12/h17H,7-8H2,1-6H3
InChIKeyKYWYAJYBTIRYKM-UHFFFAOYSA-N
MW336.53 g/mol
LogP2.89
Rot. Bonds8

About [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane

[dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane (PubChem CID 155603003) has the molecular formula C9H23F3O4Si3 and a molecular weight of 336.53 g/mol. Its IUPAC name is [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Name[dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane
PubChem CID155603003
Molecular FormulaC9H23F3O4Si3
Molecular Weight336.53 g/mol
Exact Mass336.09
IUPAC Name[dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane
SMILESCO[Si](C)(OC)O[Si](C)(CCC(F)(F)F)O[SiH](C)C
InChIInChI=1S/C9H23F3O4Si3/c1-13-19(6,14-2)16-18(5,15-17(3)4)8-7-9(10,11)12/h17H,7-8H2,1-6H3
InChIKeyKYWYAJYBTIRYKM-UHFFFAOYSA-N
XLogP2.89
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.53
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane?
The IUPAC name of [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane (CID 155603003) is [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane is CO[Si](C)(OC)O[Si](C)(CCC(F)(F)F)O[SiH](C)C.
What is the InChIKey of [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane?
The InChIKey is KYWYAJYBTIRYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23F3O4Si3/c1-13-19(6,14-2)16-18(5,15-17(3)4)8-7-9(10,11)12/h17H,7-8H2,1-6H3.
What are the key properties of [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane?
[dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane has a molecular weight of 336.53 g/mol, XLogP of 2.89, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxy(methyl)silyl]oxy-dimethylsilyloxy-methyl-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 155603003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).