tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane

C24H48O3PtSi — CID 87079059

IUPACtris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane
SMILESCO[Si](OC)(OC)C1=CC[C-]=C1C.[CH2-]CCCC.[CH2-]CCCC.[CH2-]CCCC.[Pt+4]
InChIInChI=1S/C9H15O3Si.3C5H11.Pt/c1-8-6-5-7-9(8)13(10-2,11-3)12-4;3*1-3-5-4-2;/h7H,5H2,1-4H3;3*1,3-5H2,2H3;/q4*-1;+4
InChIKeyADWOLMWRWKNMOW-UHFFFAOYSA-N
MW607.81 g/mol
LogP7.51
Rot. Bonds10

About tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane

tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane (PubChem CID 87079059) has the molecular formula C24H48O3PtSi and a molecular weight of 607.81 g/mol. Its IUPAC name is tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane.

Molecular Properties

Compound Nametris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane
PubChem CID87079059
Molecular FormulaC24H48O3PtSi
Molecular Weight607.81 g/mol
Exact Mass607.30
IUPAC Nametris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane
SMILESCO[Si](OC)(OC)C1=CC[C-]=C1C.[CH2-]CCCC.[CH2-]CCCC.[CH2-]CCCC.[Pt+4]
InChIInChI=1S/C9H15O3Si.3C5H11.Pt/c1-8-6-5-7-9(8)13(10-2,11-3)12-4;3*1-3-5-4-2;/h7H,5H2,1-4H3;3*1,3-5H2,2H3;/q4*-1;+4
InChIKeyADWOLMWRWKNMOW-UHFFFAOYSA-N
XLogP7.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500607.81
LogP ≤ 57.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane?
The IUPAC name of tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane (CID 87079059) is tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane.
What is the SMILES notation for tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane?
The canonical SMILES for tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane is CO[Si](OC)(OC)C1=CC[C-]=C1C.[CH2-]CCCC.[CH2-]CCCC.[CH2-]CCCC.[Pt+4].
What is the InChIKey of tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane?
The InChIKey is ADWOLMWRWKNMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15O3Si.3C5H11.Pt/c1-8-6-5-7-9(8)13(10-2,11-3)12-4;3*1-3-5-4-2;/h7H,5H2,1-4H3;3*1,3-5H2,2H3;/q4*-1;+4.
What are the key properties of tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane?
tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane has a molecular weight of 607.81 g/mol, XLogP of 7.51, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(pentane);platinum(4+);trimethoxy-(5-methylcyclopenta-1,4-dien-1-yl)silane is sourced from PubChem (CID 87079059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).