dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane

C11H15F11O2Si — CID 15055054

IUPACdimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane
SMILESC[SiH](C)CCCOCC(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H15F11O2Si/c1-25(2)5-3-4-23-6-7(12,9(15,16)17)24-11(21,22)8(13,14)10(18,19)20/h25H,3-6H2,1-2H3
InChIKeyXIIXVJSAQTYXGF-UHFFFAOYSA-N
MW416.30 g/mol
LogP4.91
Rot. Bonds9

About dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane

dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane (PubChem CID 15055054) has the molecular formula C11H15F11O2Si and a molecular weight of 416.30 g/mol. Its IUPAC name is dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane.

Molecular Properties

Compound Namedimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane
PubChem CID15055054
Molecular FormulaC11H15F11O2Si
Molecular Weight416.30 g/mol
Exact Mass416.07
IUPAC Namedimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane
SMILESC[SiH](C)CCCOCC(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H15F11O2Si/c1-25(2)5-3-4-23-6-7(12,9(15,16)17)24-11(21,22)8(13,14)10(18,19)20/h25H,3-6H2,1-2H3
InChIKeyXIIXVJSAQTYXGF-UHFFFAOYSA-N
XLogP4.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.30
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane?
The IUPAC name of dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane (CID 15055054) is dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane.
What is the SMILES notation for dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane?
The canonical SMILES for dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane is C[SiH](C)CCCOCC(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane?
The InChIKey is XIIXVJSAQTYXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F11O2Si/c1-25(2)5-3-4-23-6-7(12,9(15,16)17)24-11(21,22)8(13,14)10(18,19)20/h25H,3-6H2,1-2H3.
What are the key properties of dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane?
dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane has a molecular weight of 416.30 g/mol, XLogP of 4.91, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[3-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propyl]silane is sourced from PubChem (CID 15055054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).