difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane

C6F16OSi — CID 172715865

IUPACdifluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane
SMILESFC(F)(F)C(F)(F)O[Si](F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C6F16OSi/c7-1(8,3(11,12)13)2(9,10)6(19,20)24(21,22)23-5(17,18)4(14,15)16
InChIKeyFVXAONYYJVNMDD-UHFFFAOYSA-N
MW420.12 g/mol
LogP5.04
Rot. Bonds5

About difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane

difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane (PubChem CID 172715865) has the molecular formula C6F16OSi and a molecular weight of 420.12 g/mol. Its IUPAC name is difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane.

Molecular Properties

Compound Namedifluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane
PubChem CID172715865
Molecular FormulaC6F16OSi
Molecular Weight420.12 g/mol
Exact Mass419.95
IUPAC Namedifluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane
SMILESFC(F)(F)C(F)(F)O[Si](F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C6F16OSi/c7-1(8,3(11,12)13)2(9,10)6(19,20)24(21,22)23-5(17,18)4(14,15)16
InChIKeyFVXAONYYJVNMDD-UHFFFAOYSA-N
XLogP5.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.12
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecyl-tris(1,1,2,2,2-pentafluoroethoxy)silane;hexane
CID 175549890
1,1,2,2,3,3,4,4,4-nonafluorobutyl-tris(trifluoromethoxy)silane
CID 87608961
trifluoro(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctoxy)silane
CID 175857677
dichloro-fluoro-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,17-pentatriacontafluoroheptadecyl)silane
CID 90422011
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecyl-(trifluoromethoxy)-bis(trifluoromethyl)silane
CID 141429522
1,1,1,2,2,3,3,4,4-nonafluoro-4-triaminosilylbutane
CID 139751434
1,1,1,2,2,3,3,4,4-nonafluoro-4-(1,1,2,2,2-pentafluoroethoxy)butane
CID 11325674
1,1,2,2,3,3,3-heptafluoropropyl-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)-bis(trifluoromethoxy)silane
CID 139908301
1-[diamino(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecyl)silyl]-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecane
CID 172721781
trichloro(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-tritriacontafluorohexadecyl)silane
CID 155573710
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecyl(trihydroxy)silane
CID 22610622
CID 175811708
CID 175811708

Frequently Asked Questions

What is the IUPAC name of difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane?
The IUPAC name of difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane (CID 172715865) is difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane.
What is the SMILES notation for difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane?
The canonical SMILES for difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane is FC(F)(F)C(F)(F)O[Si](F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane?
The InChIKey is FVXAONYYJVNMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F16OSi/c7-1(8,3(11,12)13)2(9,10)6(19,20)24(21,22)23-5(17,18)4(14,15)16.
What are the key properties of difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane?
difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane has a molecular weight of 420.12 g/mol, XLogP of 5.04, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-(1,1,2,2,2-pentafluoroethoxy)silane is sourced from PubChem (CID 172715865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).