dichloropalladium;bis(ethyl(diphenyl)phosphane)

C28H28Cl2P2Pd-2 — CID 22638849

IUPACdichloropalladium;bis(ethyl(diphenyl)phosphane)
SMILESCl[Pd]Cl.[CH2-]CP(c1ccccc1)c1ccccc1.[CH2-]CP(c1ccccc1)c1ccccc1
InChIInChI=1S/2C14H14P.2ClH.Pd/c2*1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;;;/h2*3-12H,1-2H2;2*1H;/q2*-1;;;+2/p-2
InChIKeyDQGWZPUNACPNTP-UHFFFAOYSA-L
MW603.81 g/mol
LogP7.28
Rot. Bonds6

About dichloropalladium;bis(ethyl(diphenyl)phosphane)

dichloropalladium;bis(ethyl(diphenyl)phosphane) (PubChem CID 22638849) has the molecular formula C28H28Cl2P2Pd-2 and a molecular weight of 603.81 g/mol. Its IUPAC name is dichloropalladium;bis(ethyl(diphenyl)phosphane).

Molecular Properties

Compound Namedichloropalladium;bis(ethyl(diphenyl)phosphane)
PubChem CID22638849
Molecular FormulaC28H28Cl2P2Pd-2
Molecular Weight603.81 g/mol
Exact Mass602.01
IUPAC Namedichloropalladium;bis(ethyl(diphenyl)phosphane)
SMILESCl[Pd]Cl.[CH2-]CP(c1ccccc1)c1ccccc1.[CH2-]CP(c1ccccc1)c1ccccc1
InChIInChI=1S/2C14H14P.2ClH.Pd/c2*1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;;;/h2*3-12H,1-2H2;2*1H;/q2*-1;;;+2/p-2
InChIKeyDQGWZPUNACPNTP-UHFFFAOYSA-L
XLogP7.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500603.81
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 57485277
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dichloropalladium;ethene;bis(triphenylphosphane)
CID 44891218
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CID 172691884
diphenylphosphanylmethyl(diphenyl)phosphane;sulfane
CID 18991635
diphenylphosphanylmethyl(diphenyl)phosphane;ruthenium
CID 87761562
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CID 134888828
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Frequently Asked Questions

What is the IUPAC name of dichloropalladium;bis(ethyl(diphenyl)phosphane)?
The IUPAC name of dichloropalladium;bis(ethyl(diphenyl)phosphane) (CID 22638849) is dichloropalladium;bis(ethyl(diphenyl)phosphane).
What is the SMILES notation for dichloropalladium;bis(ethyl(diphenyl)phosphane)?
The canonical SMILES for dichloropalladium;bis(ethyl(diphenyl)phosphane) is Cl[Pd]Cl.[CH2-]CP(c1ccccc1)c1ccccc1.[CH2-]CP(c1ccccc1)c1ccccc1.
What is the InChIKey of dichloropalladium;bis(ethyl(diphenyl)phosphane)?
The InChIKey is DQGWZPUNACPNTP-UHFFFAOYSA-L. The full InChI is InChI=1S/2C14H14P.2ClH.Pd/c2*1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;;;/h2*3-12H,1-2H2;2*1H;/q2*-1;;;+2/p-2.
What are the key properties of dichloropalladium;bis(ethyl(diphenyl)phosphane)?
dichloropalladium;bis(ethyl(diphenyl)phosphane) has a molecular weight of 603.81 g/mol, XLogP of 7.28, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloropalladium;bis(ethyl(diphenyl)phosphane) is sourced from PubChem (CID 22638849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).