bis(octadecanoate);platinum(2+)

C36H70O4Pt — CID 87233709

IUPACbis(octadecanoate);platinum(2+)
SMILESCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Pt+2]
InChIInChI=1S/2C18H36O2.Pt/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2*2-17H2,1H3,(H,19,20);/q;;+2/p-2
InChIKeyQFHGCXPGHJGZKV-UHFFFAOYSA-L
MW762.03 g/mol
LogP9.99
Rot. Bonds32

About bis(octadecanoate);platinum(2+)

bis(octadecanoate);platinum(2+) (PubChem CID 87233709) has the molecular formula C36H70O4Pt and a molecular weight of 762.03 g/mol. Its IUPAC name is bis(octadecanoate);platinum(2+).

Molecular Properties

Compound Namebis(octadecanoate);platinum(2+)
PubChem CID87233709
Molecular FormulaC36H70O4Pt
Molecular Weight762.03 g/mol
Exact Mass761.49
IUPAC Namebis(octadecanoate);platinum(2+)
SMILESCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Pt+2]
InChIInChI=1S/2C18H36O2.Pt/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2*2-17H2,1H3,(H,19,20);/q;;+2/p-2
InChIKeyQFHGCXPGHJGZKV-UHFFFAOYSA-L
XLogP9.99
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds32
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500762.03
LogP ≤ 59.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 23623890
CID 23623890
octadecanoate
CID 3033836
dimagnesium;octadecanoate
CID 19105820
magnesium;docosanoate;octadecanoate
CID 158868243
decanoate;lanthanum(3+)
CID 21139452
calcium;hexadecanoate;octadecanoate
CID 22065418
bis(undecanoate);zirconium(2+)
CID 18995554
manganese(2+);bis(tricosanoate)
CID 100951425
potassium heptanoate
CID 23681741
tetrakis(hexadecanoate);iridium
CID 173340545
gold(1+);octadecanoate
CID 23509280
diazanium bis(decanoate)
CID 141069575

Frequently Asked Questions

What is the IUPAC name of bis(octadecanoate);platinum(2+)?
The IUPAC name of bis(octadecanoate);platinum(2+) (CID 87233709) is bis(octadecanoate);platinum(2+).
What is the SMILES notation for bis(octadecanoate);platinum(2+)?
The canonical SMILES for bis(octadecanoate);platinum(2+) is CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Pt+2].
What is the InChIKey of bis(octadecanoate);platinum(2+)?
The InChIKey is QFHGCXPGHJGZKV-UHFFFAOYSA-L. The full InChI is InChI=1S/2C18H36O2.Pt/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2*2-17H2,1H3,(H,19,20);/q;;+2/p-2.
What are the key properties of bis(octadecanoate);platinum(2+)?
bis(octadecanoate);platinum(2+) has a molecular weight of 762.03 g/mol, XLogP of 9.99, 32 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(octadecanoate);platinum(2+) is sourced from PubChem (CID 87233709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).