phenylsilane;tetrakis(triphenylphosphane)

C78H68P4Si — CID 160681988

IUPACphenylsilane;tetrakis(triphenylphosphane)
SMILES[SiH3]c1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/4C18H15P.C6H8Si/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-6-4-2-1-3-5-6/h4*1-15H;1-5H,7H3
InChIKeyROGOFPXAUZXIIO-UHFFFAOYSA-N
MW1157.38 g/mol
LogP13.46
Rot. Bonds12

About phenylsilane;tetrakis(triphenylphosphane)

phenylsilane;tetrakis(triphenylphosphane) (PubChem CID 160681988) has the molecular formula C78H68P4Si and a molecular weight of 1157.38 g/mol. Its IUPAC name is phenylsilane;tetrakis(triphenylphosphane).

Molecular Properties

Compound Namephenylsilane;tetrakis(triphenylphosphane)
PubChem CID160681988
Molecular FormulaC78H68P4Si
Molecular Weight1157.38 g/mol
Exact Mass1156.40
IUPAC Namephenylsilane;tetrakis(triphenylphosphane)
SMILES[SiH3]c1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/4C18H15P.C6H8Si/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-6-4-2-1-3-5-6/h4*1-15H;1-5H,7H3
InChIKeyROGOFPXAUZXIIO-UHFFFAOYSA-N
XLogP13.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms83
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001157.38
LogP ≤ 513.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

triphenylphosphane
CID 139056248
tris(triphenylphosphane);hydrobromide
CID 172722268
tris(triphenylphosphane);trihydrochloride
CID 173282987
palladium;bis(triphenylphosphane)
CID 10122028
triphenylphosphane;yttrium
CID 139917776
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
copper monohydride;hexakis(triphenylphosphane)
CID 134992255
silane;triphenylphosphane
CID 161037280
plutonium;triphenylphosphane
CID 161300359
iron dihydride;tetrakis(triphenylphosphane)
CID 172730134
CID 87948921
CID 87948921
triphenylphosphane;octahydrochloride
CID 172751742

Frequently Asked Questions

What is the IUPAC name of phenylsilane;tetrakis(triphenylphosphane)?
The IUPAC name of phenylsilane;tetrakis(triphenylphosphane) (CID 160681988) is phenylsilane;tetrakis(triphenylphosphane).
What is the SMILES notation for phenylsilane;tetrakis(triphenylphosphane)?
The canonical SMILES for phenylsilane;tetrakis(triphenylphosphane) is [SiH3]c1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of phenylsilane;tetrakis(triphenylphosphane)?
The InChIKey is ROGOFPXAUZXIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/4C18H15P.C6H8Si/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-6-4-2-1-3-5-6/h4*1-15H;1-5H,7H3.
What are the key properties of phenylsilane;tetrakis(triphenylphosphane)?
phenylsilane;tetrakis(triphenylphosphane) has a molecular weight of 1157.38 g/mol, XLogP of 13.46, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenylsilane;tetrakis(triphenylphosphane) is sourced from PubChem (CID 160681988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).