potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane

C42H81F3KNO10SSi2 — CID 158125382

About potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane

potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane (PubChem CID 158125382) has the molecular formula C42H81F3KNO10SSi2 and a molecular weight of 944.44 g/mol. Its IUPAC name is potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane.

Molecular Properties

• Compound Name: potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane
• PubChem CID: 158125382
• Molecular Formula: C42H81F3KNO10SSi2
• Molecular Weight: 944.44 g/mol
• Exact Mass: 943.47
• IUPAC Name: potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane
• SMILES: C.C.CCC(C)c1ccc(C(=O)[N-]S(=O)(=O)C(F)(F)F)cc1.CCCC[Si](C)(C)O[Si](C)(C)CCCOC(=O)C(C)(C)CC.CCOCCOCCOC(=O)C(C)CC.[K+]
• InChI: InChI=1S/C17H38O3Si2.C12H14F3NO3S.C11H22O4.2CH4.K/c1-9-11-14-21(5,6)20-22(7,8)15-12-13-19-16(18)17(3,4)10-2;1-3-8(2)9-4-6-10(7-5-9)11(17)16-20(18,19)12(13,14)15;1-4-10(3)11(12)15-9-8-14-7-6-13-5-2;;;/h9-15H2,1-8H3;4-8H,3H2,1-2H3,(H,16,17);10H,4-9H2,1-3H3;2*1H4;/q;;;;;+1/p-1
• InChIKey: RSELTCPUNXMLPM-UHFFFAOYSA-M
• XLogP: 9.05
• TPSA: 145.60 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 24
• Heavy Atoms: 60
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	944.44
LogP ≤ 5	9.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane?

The IUPAC name of potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane (CID 158125382) is potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane.

What is the SMILES notation for potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane?

The canonical SMILES for potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane is C.C.CCC(C)c1ccc(C(=O)[N-]S(=O)(=O)C(F)(F)F)cc1.CCCC[Si](C)(C)O[Si](C)(C)CCCOC(=O)C(C)(C)CC.CCOCCOCCOC(=O)C(C)CC.[K+].

What is the InChIKey of potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane?

The InChIKey is RSELTCPUNXMLPM-UHFFFAOYSA-M. The full InChI is InChI=1S/C17H38O3Si2.C12H14F3NO3S.C11H22O4.2CH4.K/c1-9-11-14-21(5,6)20-22(7,8)15-12-13-19-16(18)17(3,4)10-2;1-3-8(2)9-4-6-10(7-5-9)11(17)16-20(18,19)12(13,14)15;1-4-10(3)11(12)15-9-8-14-7-6-13-5-2;;;/h9-15H2,1-8H3;4-8H,3H2,1-2H3,(H,16,17);10H,4-9H2,1-3H3;2*1H4;/q;;;;;+1/p-1.

What are the key properties of potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane?

potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane has a molecular weight of 944.44 g/mol, XLogP of 9.05, 24 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;(4-butan-2-ylbenzoyl)-(trifluoromethylsulfonyl)azanide;3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2,2-dimethylbutanoate;2-(2-ethoxyethoxy)ethyl 2-methylbutanoate;methane is sourced from PubChem (CID 158125382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).