benzene;dichloropalladium;phosphate

C6H5Cl2O4PPd-4 — CID 175492461

IUPACbenzene;dichloropalladium;phosphate
SMILESCl[Pd]Cl.O=P([O-])([O-])[O-].[c-]1ccccc1
InChIInChI=1S/C6H5.2ClH.H3O4P.Pd/c1-2-4-6-5-3-1;;;1-5(2,3)4;/h1-5H;2*1H;(H3,1,2,3,4);/q-1;;;;+2/p-5
InChIKeyDPLJFEZELWVXMR-UHFFFAOYSA-I
MW349.40 g/mol
LogP0.04
Rot. Bonds

About benzene;dichloropalladium;phosphate

benzene;dichloropalladium;phosphate (PubChem CID 175492461) has the molecular formula C6H5Cl2O4PPd-4 and a molecular weight of 349.40 g/mol. Its IUPAC name is benzene;dichloropalladium;phosphate.

Molecular Properties

Compound Namebenzene;dichloropalladium;phosphate
PubChem CID175492461
Molecular FormulaC6H5Cl2O4PPd-4
Molecular Weight349.40 g/mol
Exact Mass347.84
IUPAC Namebenzene;dichloropalladium;phosphate
SMILESCl[Pd]Cl.O=P([O-])([O-])[O-].[c-]1ccccc1
InChIInChI=1S/C6H5.2ClH.H3O4P.Pd/c1-2-4-6-5-3-1;;;1-5(2,3)4;/h1-5H;2*1H;(H3,1,2,3,4);/q-1;;;;+2/p-5
InChIKeyDPLJFEZELWVXMR-UHFFFAOYSA-I
XLogP0.04
TPSA86.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.40
LogP ≤ 50.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzene;dichloropalladium;phosphate?
The IUPAC name of benzene;dichloropalladium;phosphate (CID 175492461) is benzene;dichloropalladium;phosphate.
What is the SMILES notation for benzene;dichloropalladium;phosphate?
The canonical SMILES for benzene;dichloropalladium;phosphate is Cl[Pd]Cl.O=P([O-])([O-])[O-].[c-]1ccccc1.
What is the InChIKey of benzene;dichloropalladium;phosphate?
The InChIKey is DPLJFEZELWVXMR-UHFFFAOYSA-I. The full InChI is InChI=1S/C6H5.2ClH.H3O4P.Pd/c1-2-4-6-5-3-1;;;1-5(2,3)4;/h1-5H;2*1H;(H3,1,2,3,4);/q-1;;;;+2/p-5.
What are the key properties of benzene;dichloropalladium;phosphate?
benzene;dichloropalladium;phosphate has a molecular weight of 349.40 g/mol, XLogP of 0.04, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;dichloropalladium;phosphate is sourced from PubChem (CID 175492461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).