diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane

C10H17F7OSi — CID 59112306

IUPACdiethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane
SMILESCC[Si](CC)(CCC(F)(F)C(F)(F)C(F)(F)F)OC
InChIInChI=1S/C10H17F7OSi/c1-4-19(5-2,18-3)7-6-8(11,12)9(13,14)10(15,16)17/h4-7H2,1-3H3
InChIKeyWRQRRUDWLMWEAT-UHFFFAOYSA-N
MW314.32 g/mol
LogP4.84
Rot. Bonds7

About diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane

diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane (PubChem CID 59112306) has the molecular formula C10H17F7OSi and a molecular weight of 314.32 g/mol. Its IUPAC name is diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane.

Molecular Properties

Compound Namediethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane
PubChem CID59112306
Molecular FormulaC10H17F7OSi
Molecular Weight314.32 g/mol
Exact Mass314.09
IUPAC Namediethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane
SMILESCC[Si](CC)(CCC(F)(F)C(F)(F)C(F)(F)F)OC
InChIInChI=1S/C10H17F7OSi/c1-4-19(5-2,18-3)7-6-8(11,12)9(13,14)10(15,16)17/h4-7H2,1-3H3
InChIKeyWRQRRUDWLMWEAT-UHFFFAOYSA-N
XLogP4.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 54.84
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'}

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Related Compounds

methoxy-propyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-(3,3,3-trifluoropropyl)silane
CID 59112316
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-hentriacontafluoroheptadecyl(trimethoxy)silane
CID 175694492
dimethoxy-methyl-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silane
CID 22600762
dimethoxy-methyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane
CID 2776323
[3,3,4,4,5,5,6,6,7,8,8,8-dodecafluoro-7-(trifluoromethyl)octyl]-trimethoxysilane
CID 25261174
[3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluoromethyl)dodecyl]-trimethoxysilane
CID 25261329
triethyl(3,3,4,4,5,5,6,6,6-nonafluorohexoxy)silane
CID 132934764
ethoxy-(3,3,4,4,5,5,5-heptafluoropentyl)-dimethylsilane
CID 59112366
dihydroxy-methoxy-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane
CID 146679665
ethane;3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl(trimethoxy)silane;trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)silane
CID 158052991
triethoxy(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)silane;triethoxy(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentacosafluorotetradecyl)silane
CID 171316019
triethoxy(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)silane;triethoxy(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silane
CID 159728593

Frequently Asked Questions

What is the IUPAC name of diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane?
The IUPAC name of diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane (CID 59112306) is diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane.
What is the SMILES notation for diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane?
The canonical SMILES for diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane is CC[Si](CC)(CCC(F)(F)C(F)(F)C(F)(F)F)OC.
What is the InChIKey of diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane?
The InChIKey is WRQRRUDWLMWEAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F7OSi/c1-4-19(5-2,18-3)7-6-8(11,12)9(13,14)10(15,16)17/h4-7H2,1-3H3.
What are the key properties of diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane?
diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane has a molecular weight of 314.32 g/mol, XLogP of 4.84, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(3,3,4,4,5,5,5-heptafluoropentyl)-methoxysilane is sourced from PubChem (CID 59112306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).