methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane

C11H18F8O2Si — CID 20781314

IUPACmethoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane
SMILESCO[Si](C)(C)CCCOCC(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C11H18F8O2Si/c1-20-22(2,3)6-4-5-21-7-9(14,15)11(18,19)10(16,17)8(12)13/h8H,4-7H2,1-3H3
InChIKeyNLVLYBAKGVKRBC-UHFFFAOYSA-N
MW362.33 g/mol
LogP4.42
Rot. Bonds10

About methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane

methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane (PubChem CID 20781314) has the molecular formula C11H18F8O2Si and a molecular weight of 362.33 g/mol. Its IUPAC name is methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane.

Molecular Properties

Compound Namemethoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane
PubChem CID20781314
Molecular FormulaC11H18F8O2Si
Molecular Weight362.33 g/mol
Exact Mass362.09
IUPAC Namemethoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane
SMILESCO[Si](C)(C)CCCOCC(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C11H18F8O2Si/c1-20-22(2,3)6-4-5-21-7-9(14,15)11(18,19)10(16,17)8(12)13/h8H,4-7H2,1-3H3
InChIKeyNLVLYBAKGVKRBC-UHFFFAOYSA-N
XLogP4.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.33
LogP ≤ 54.42
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 methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane?
The IUPAC name of methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane (CID 20781314) is methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane.
What is the SMILES notation for methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane?
The canonical SMILES for methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane is CO[Si](C)(C)CCCOCC(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane?
The InChIKey is NLVLYBAKGVKRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F8O2Si/c1-20-22(2,3)6-4-5-21-7-9(14,15)11(18,19)10(16,17)8(12)13/h8H,4-7H2,1-3H3.
What are the key properties of methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane?
methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane has a molecular weight of 362.33 g/mol, XLogP of 4.42, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-dimethyl-[3-(2,2,3,3,4,4,5,5-octafluoropentoxy)propyl]silane is sourced from PubChem (CID 20781314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).