tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride

C40H80Cl4F24Mg4N4O32S8 — CID 139051336

IUPACtetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride
SMILESCOCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.[Cl-].[Cl-].[Cl-].[Cl-].[Mg+2].[Mg+2].[Mg+2].[Mg+2]
InChIInChI=1S/8C4H10O2.4C2F6NO4S2.4ClH.4Mg/c8*1-5-3-4-6-2;4*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;;;;;;;;/h8*3-4H2,1-2H3;;;;;4*1H;;;;/q;;;;;;;;4*-1;;;;;4*+2/p-4
InChIKeyRUDFOTUBKSYUKV-UHFFFAOYSA-J
MW2080.60 g/mol
LogP-7.04
Rot. Bonds32

About tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride

tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride (PubChem CID 139051336) has the molecular formula C40H80Cl4F24Mg4N4O32S8 and a molecular weight of 2080.60 g/mol. Its IUPAC name is tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride.

Molecular Properties

Compound Nametetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride
PubChem CID139051336
Molecular FormulaC40H80Cl4F24Mg4N4O32S8
Molecular Weight2080.60 g/mol
Exact Mass2076.03
IUPAC Nametetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride
SMILESCOCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.[Cl-].[Cl-].[Cl-].[Cl-].[Mg+2].[Mg+2].[Mg+2].[Mg+2]
InChIInChI=1S/8C4H10O2.4C2F6NO4S2.4ClH.4Mg/c8*1-5-3-4-6-2;4*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;;;;;;;;/h8*3-4H2,1-2H3;;;;;4*1H;;;;/q;;;;;;;;4*-1;;;;;4*+2/p-4
InChIKeyRUDFOTUBKSYUKV-UHFFFAOYSA-J
XLogP-7.04
TPSA477.20 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds32
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002080.60
LogP ≤ 5-7.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

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

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Related Compounds

magnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);manganese(2+)
CID 163413533
bis(trifluoromethylsulfonyl)azanide;N-ethyl-2,2,2-trifluoro-N-(2-methoxyethyl)ethanamine
CID 157108793
bis(trifluoromethylsulfonyl)azanide;gold(1+)
CID 102109298
bis(trifluoromethylsulfonyl)azanide;uranium
CID 162552088
bis(trifluoromethylsulfonyl)azanide;2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1,3-thiazol-3-ium
CID 159805189
bis(trifluoromethylsulfonyl)azanide;triethylazanium
CID 11014427
bis(trifluoromethylsulfonyl)azanide;tributyl(methoxymethyl)phosphanium
CID 158418130
bis(trifluoromethylsulfonyl)azanide;1-(methoxymethyl)-3-methylimidazol-3-ium
CID 23628825
magnesium;1,2-dimethoxyethane;dichloride
CID 174702876
magnesium;bis(1,1,2,2,2-pentafluoroethylsulfonyl)azanide;chloride
CID 140785394
bis(trifluoromethylsulfonyl)azanide;tetrapropylazanium
CID 141376230
bis(trifluoromethylsulfonyl)azanide;2-ethoxyethyl(triethyl)azanium
CID 134716438

Frequently Asked Questions

What is the IUPAC name of tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride?
The IUPAC name of tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride (CID 139051336) is tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride.
What is the SMILES notation for tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride?
The canonical SMILES for tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride is COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.COCCOC.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.[Cl-].[Cl-].[Cl-].[Cl-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].
What is the InChIKey of tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride?
The InChIKey is RUDFOTUBKSYUKV-UHFFFAOYSA-J. The full InChI is InChI=1S/8C4H10O2.4C2F6NO4S2.4ClH.4Mg/c8*1-5-3-4-6-2;4*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;;;;;;;;/h8*3-4H2,1-2H3;;;;;4*1H;;;;/q;;;;;;;;4*-1;;;;;4*+2/p-4.
What are the key properties of tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride?
tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride has a molecular weight of 2080.60 g/mol, XLogP of -7.04, 32 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for tetramagnesium;tetrakis(bis(trifluoromethylsulfonyl)azanide);octakis(1,2-dimethoxyethane);tetrachloride is sourced from PubChem (CID 139051336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).