palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide

C18H42Br2P2Pd — CID 175774543

IUPACpalladium(2+);bis(tri(propan-2-yl)phosphane);dibromide
SMILESCC(C)P(C(C)C)C(C)C.CC(C)P(C(C)C)C(C)C.[Br-].[Br-].[Pd+2]
InChIInChI=1S/2C9H21P.2BrH.Pd/c2*1-7(2)10(8(3)4)9(5)6;;;/h2*7-9H,1-6H3;2*1H;/q;;;;+2/p-2
InChIKeyMSBOPULLRPTVKW-UHFFFAOYSA-L
MW586.71 g/mol
LogP1.39
Rot. Bonds6

About palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide

palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide (PubChem CID 175774543) has the molecular formula C18H42Br2P2Pd and a molecular weight of 586.71 g/mol. Its IUPAC name is palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide.

Molecular Properties

Compound Namepalladium(2+);bis(tri(propan-2-yl)phosphane);dibromide
PubChem CID175774543
Molecular FormulaC18H42Br2P2Pd
Molecular Weight586.71 g/mol
Exact Mass584.02
IUPAC Namepalladium(2+);bis(tri(propan-2-yl)phosphane);dibromide
SMILESCC(C)P(C(C)C)C(C)C.CC(C)P(C(C)C)C(C)C.[Br-].[Br-].[Pd+2]
InChIInChI=1S/2C9H21P.2BrH.Pd/c2*1-7(2)10(8(3)4)9(5)6;;;/h2*7-9H,1-6H3;2*1H;/q;;;;+2/p-2
InChIKeyMSBOPULLRPTVKW-UHFFFAOYSA-L
XLogP1.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500586.71
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide?
The IUPAC name of palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide (CID 175774543) is palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide.
What is the SMILES notation for palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide?
The canonical SMILES for palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide is CC(C)P(C(C)C)C(C)C.CC(C)P(C(C)C)C(C)C.[Br-].[Br-].[Pd+2].
What is the InChIKey of palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide?
The InChIKey is MSBOPULLRPTVKW-UHFFFAOYSA-L. The full InChI is InChI=1S/2C9H21P.2BrH.Pd/c2*1-7(2)10(8(3)4)9(5)6;;;/h2*7-9H,1-6H3;2*1H;/q;;;;+2/p-2.
What are the key properties of palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide?
palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide has a molecular weight of 586.71 g/mol, XLogP of 1.39, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide is sourced from PubChem (CID 175774543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).