dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride

C11H15Cl2PPt — CID 138401813

IUPACdimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride
SMILESC#C[CH2-].CP(C)c1ccccc1.Cl.[Cl-].[Pt+2]
InChIInChI=1S/C8H11P.C3H3.2ClH.Pt/c1-9(2)8-6-4-3-5-7-8;1-3-2;;;/h3-7H,1-2H3;1H,2H2;2*1H;/q;-1;;;+2/p-1
InChIKeyQMNCWZZHCKWBIT-UHFFFAOYSA-M
MW444.20 g/mol
LogP-0.07
Rot. Bonds1

About dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride

dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride (PubChem CID 138401813) has the molecular formula C11H15Cl2PPt and a molecular weight of 444.20 g/mol. Its IUPAC name is dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride.

Molecular Properties

Compound Namedimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride
PubChem CID138401813
Molecular FormulaC11H15Cl2PPt
Molecular Weight444.20 g/mol
Exact Mass442.99
IUPAC Namedimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride
SMILESC#C[CH2-].CP(C)c1ccccc1.Cl.[Cl-].[Pt+2]
InChIInChI=1S/C8H11P.C3H3.2ClH.Pt/c1-9(2)8-6-4-3-5-7-8;1-3-2;;;/h3-7H,1-2H3;1H,2H2;2*1H;/q;-1;;;+2/p-1
InChIKeyQMNCWZZHCKWBIT-UHFFFAOYSA-M
XLogP-0.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.20
LogP ≤ 5-0.07
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate
CID 135082456
dimethyl(phenyl)phosphane;gold(1+);azide
CID 166731380
dimethyl(phenyl)phosphane;ethane;phosphoryl trichloride
CID 91487887
methyl(diphenyl)phosphane;palladium(2+);dichloride
CID 175235701
borane;methyl(diphenyl)phosphane
CID 13485169
tris(triphenylphosphane);trihydrochloride
CID 173282987
triphenylphosphane;yttrium
CID 139917776
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
triphenylphosphane;octahydrochloride
CID 172751742
magnesium;methanidyl(diphenyl)phosphane;chloride
CID 87245376
carbanide;gold(1+);methyl(diphenyl)phosphane
CID 87994939
[methyl(phenyl)phosphanyl]boranuide
CID 102383944

Frequently Asked Questions

What is the IUPAC name of dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride?
The IUPAC name of dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride (CID 138401813) is dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride.
What is the SMILES notation for dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride?
The canonical SMILES for dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride is C#C[CH2-].CP(C)c1ccccc1.Cl.[Cl-].[Pt+2].
What is the InChIKey of dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride?
The InChIKey is QMNCWZZHCKWBIT-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H11P.C3H3.2ClH.Pt/c1-9(2)8-6-4-3-5-7-8;1-3-2;;;/h3-7H,1-2H3;1H,2H2;2*1H;/q;-1;;;+2/p-1.
What are the key properties of dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride?
dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride has a molecular weight of 444.20 g/mol, XLogP of -0.07, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(phenyl)phosphane;platinum(2+);prop-1-yne;chloride;hydrochloride is sourced from PubChem (CID 138401813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).