methyl(diphenyl)phosphane;palladium(2+);dichloride

C13H13Cl2PPd — CID 175235701

IUPACmethyl(diphenyl)phosphane;palladium(2+);dichloride
SMILESCP(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Pd+2]
InChIInChI=1S/C13H13P.2ClH.Pd/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;;;/h2-11H,1H3;2*1H;/q;;;+2/p-2
InChIKeyDRNMZJQSWOUQDB-UHFFFAOYSA-L
MW377.55 g/mol
LogP-3.25
Rot. Bonds2

About methyl(diphenyl)phosphane;palladium(2+);dichloride

methyl(diphenyl)phosphane;palladium(2+);dichloride (PubChem CID 175235701) has the molecular formula C13H13Cl2PPd and a molecular weight of 377.55 g/mol. Its IUPAC name is methyl(diphenyl)phosphane;palladium(2+);dichloride.

Molecular Properties

Compound Namemethyl(diphenyl)phosphane;palladium(2+);dichloride
PubChem CID175235701
Molecular FormulaC13H13Cl2PPd
Molecular Weight377.55 g/mol
Exact Mass375.92
IUPAC Namemethyl(diphenyl)phosphane;palladium(2+);dichloride
SMILESCP(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Pd+2]
InChIInChI=1S/C13H13P.2ClH.Pd/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;;;/h2-11H,1H3;2*1H;/q;;;+2/p-2
InChIKeyDRNMZJQSWOUQDB-UHFFFAOYSA-L
XLogP-3.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.55
LogP ≤ 5-3.25
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

borane;methyl(diphenyl)phosphane
CID 13485169
carbanide;gold(1+);methyl(diphenyl)phosphane
CID 87994939
dichlororuthenium;bis(methyl(diphenyl)phosphane)
CID 175433637
CID 164679845
CID 164679845
gold(1+);methyl(diphenyl)phosphane;trifluoromethane
CID 134981383
ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane
CID 158097838
methyl(diphenyl)phosphane;terephthalic acid
CID 175491126
CID 11278244
CID 11278244
CID 19922556
CID 19922556
2-[methyl(phenyl)phosphanyl]phenol
CID 11820610
triphenylphosphane;yttrium
CID 139917776
[methyl(phenyl)phosphanyl]boranuide
CID 102383944

Frequently Asked Questions

What is the IUPAC name of methyl(diphenyl)phosphane;palladium(2+);dichloride?
The IUPAC name of methyl(diphenyl)phosphane;palladium(2+);dichloride (CID 175235701) is methyl(diphenyl)phosphane;palladium(2+);dichloride.
What is the SMILES notation for methyl(diphenyl)phosphane;palladium(2+);dichloride?
The canonical SMILES for methyl(diphenyl)phosphane;palladium(2+);dichloride is CP(c1ccccc1)c1ccccc1.[Cl-].[Cl-].[Pd+2].
What is the InChIKey of methyl(diphenyl)phosphane;palladium(2+);dichloride?
The InChIKey is DRNMZJQSWOUQDB-UHFFFAOYSA-L. The full InChI is InChI=1S/C13H13P.2ClH.Pd/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;;;/h2-11H,1H3;2*1H;/q;;;+2/p-2.
What are the key properties of methyl(diphenyl)phosphane;palladium(2+);dichloride?
methyl(diphenyl)phosphane;palladium(2+);dichloride has a molecular weight of 377.55 g/mol, XLogP of -3.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(diphenyl)phosphane;palladium(2+);dichloride is sourced from PubChem (CID 175235701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).