ruthenium;tetrakis(tris(2-methylpropyl) phosphite)

C48H108O12P4Ru — CID 173315514

IUPACruthenium;tetrakis(tris(2-methylpropyl) phosphite)
SMILESCC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.[Ru]
InChIInChI=1S/4C12H27O3P.Ru/c4*1-10(2)7-13-16(14-8-11(3)4)15-9-12(5)6;/h4*10-12H,7-9H2,1-6H3;
InChIKeyHSGOUJRFWHKYBH-UHFFFAOYSA-N
MW1102.35 g/mol
LogP16.92
Rot. Bonds36

About ruthenium;tetrakis(tris(2-methylpropyl) phosphite)

ruthenium;tetrakis(tris(2-methylpropyl) phosphite) (PubChem CID 173315514) has the molecular formula C48H108O12P4Ru and a molecular weight of 1102.35 g/mol. Its IUPAC name is ruthenium;tetrakis(tris(2-methylpropyl) phosphite).

Molecular Properties

Compound Nameruthenium;tetrakis(tris(2-methylpropyl) phosphite)
PubChem CID173315514
Molecular FormulaC48H108O12P4Ru
Molecular Weight1102.35 g/mol
Exact Mass1102.58
IUPAC Nameruthenium;tetrakis(tris(2-methylpropyl) phosphite)
SMILESCC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.[Ru]
InChIInChI=1S/4C12H27O3P.Ru/c4*1-10(2)7-13-16(14-8-11(3)4)15-9-12(5)6;/h4*10-12H,7-9H2,1-6H3;
InChIKeyHSGOUJRFWHKYBH-UHFFFAOYSA-N
XLogP16.92
TPSA110.76 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds36
Heavy Atoms65
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001102.35
LogP ≤ 516.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Related Compounds

magnesium 2-methylpropyl phosphite
CID 22914060
chloro-methyl-(2-methylpropoxy)phosphane;ethane
CID 144828802
antimony(3+);tris(bis(2-methylpropyl) phosphite)
CID 23464204
methane;2-methyl-1-(2-methylpropoxy)propane
CID 162245040
1-[bis[2-(2-methylprop-2-enoyloxy)propoxy]phosphanyloxy]propan-2-yl 2-methylprop-2-enoate
CID 139653960
2-methylpropoxyaluminum(2+) dibromide
CID 19936986
ethane;2-methyl-1-propan-2-yloxypropane
CID 143798682
ethane;2-methyl-1-propan-2-yloxypropane
CID 145385710
bis(2-methylpropoxy)methylsilane
CID 123767341
bis(3-methylphenyl)-(2-methylpropoxy)phosphane
CID 175344000
phosphorous acid;tris(6-methylheptyl) phosphite
CID 87841257
ethanol;2-methyl-1-(2-methylpropoxy)propane
CID 23506368

Frequently Asked Questions

What is the IUPAC name of ruthenium;tetrakis(tris(2-methylpropyl) phosphite)?
The IUPAC name of ruthenium;tetrakis(tris(2-methylpropyl) phosphite) (CID 173315514) is ruthenium;tetrakis(tris(2-methylpropyl) phosphite).
What is the SMILES notation for ruthenium;tetrakis(tris(2-methylpropyl) phosphite)?
The canonical SMILES for ruthenium;tetrakis(tris(2-methylpropyl) phosphite) is CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.CC(C)COP(OCC(C)C)OCC(C)C.[Ru].
What is the InChIKey of ruthenium;tetrakis(tris(2-methylpropyl) phosphite)?
The InChIKey is HSGOUJRFWHKYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/4C12H27O3P.Ru/c4*1-10(2)7-13-16(14-8-11(3)4)15-9-12(5)6;/h4*10-12H,7-9H2,1-6H3;.
What are the key properties of ruthenium;tetrakis(tris(2-methylpropyl) phosphite)?
ruthenium;tetrakis(tris(2-methylpropyl) phosphite) has a molecular weight of 1102.35 g/mol, XLogP of 16.92, 36 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for ruthenium;tetrakis(tris(2-methylpropyl) phosphite) is sourced from PubChem (CID 173315514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).