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12-Deoxyphorbol 13-phenylacetate 20-acetate

Base Information
  • Chemical Name:12-Deoxyphorbol 13-phenylacetate 20-acetate
  • CAS No.:54662-30-5
  • Molecular Formula:C30H36 O7
  • Molecular Weight:508.66
  • Hs Code.:
  • DSSTox Substance ID:DTXSID20969948
  • Nikkaji Number:J395.411K
  • ChEMBL ID:CHEMBL1395147
  • Mol file:54662-30-5.mol
12-Deoxyphorbol 13-phenylacetate 20-acetate

Synonyms:12-deoxyphorbol 13-phenylacetate 20-acetate;12-deoxyphorbolphenylacetate-20-acetate;12-DOPPAA

Suppliers and Price of 12-Deoxyphorbol 13-phenylacetate 20-acetate
Supply Marketing:
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • TRC
  • 12-Deoxyphorbol13-phenylacetate20-acetate
  • 2.5mg
  • $ 855.00
  • TRC
  • 12-Deoxyphorbol13-phenylacetate20-acetate
  • 1mg
  • $ 495.00
  • Sigma-Aldrich
  • dPPA ≥98% (HPLC)
  • 1mg
  • $ 154.00
  • American Custom Chemicals Corporation
  • 12-DEOXYPHORBOL 13-PHENYLACETATE 20-ACETATE 95.00%
  • 5MG
  • $ 504.10
Total 8 raw suppliers
Chemical Property of 12-Deoxyphorbol 13-phenylacetate 20-acetate
Chemical Property:
  • Vapor Pressure:4.96E-17mmHg at 25°C 
  • Refractive Index:1.6810 (estimate) 
  • Boiling Point:635.7°C at 760 mmHg 
  • Flash Point:204.3°C 
  • PSA:110.13000 
  • Density:1.29g/cm3 
  • LogP:3.32370 
  • Storage Temp.:?20°C 
  • XLogP3:2.9
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:7
  • Rotatable Bond Count:7
  • Exact Mass:508.24610348
  • Heavy Atom Count:37
  • Complexity:1070
Purity/Quality:

98%Min *data from raw suppliers

12-Deoxyphorbol13-phenylacetate20-acetate *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes:T+ 
  • Statements: 26/27/28-36/37/38 
  • Safety Statements: 26-27-36/37/39-45 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1CC2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)COC(=O)C)O)C)O)OC(=O)CC5=CC=CC=C5
  • Isomeric SMILES:C[C@@H]1C[C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)COC(=O)C)O)C)O)OC(=O)CC5=CC=CC=C5
Refernces

Synthesis, spectroscopic characterization, and crystal structure of the bimetallic complex [Ni2(μ-CO)(CO)2(μ-NH(PPh2)2)2]

10.1021/ic990773s

The research focuses on the synthesis, spectroscopic characterization, crystal structure, and theoretical calculations of the dinuclear nickel(0) complex [Ni2(μ-CO)(CO)2(μ-dppa)2] (where dppa is bis(diphenylphosphino)amine). The complex was synthesized via two methods, yielding a stable microcrystalline yellow solid. The first method involved the reaction of Ni(CO)4 with the dppa ligand in benzene, while the second method used NiCl2·6H2O with dppa in methanol and sodium tetrahydroborate as a reducing agent with carbon monoxide. The synthesized complex was characterized using elemental analysis, infrared (IR) spectroscopy, proton and phosphorus-31 nuclear magnetic resonance (1H and 31P NMR), and cyclic voltammetry. The crystal structure was determined through X-ray diffraction, revealing a triclinic crystal system with a P1 space group and specific unit cell dimensions. Theoretical calculations using a semiempirical PM3 Hamiltonian were also conducted to predict bond orders and reactivity, supported by the Fukui function analysis. The complex was found to absorb carbon monoxide, leading to the formation of a mixture of nickel carbonyl compounds, and showed electrochemical behavior indicative of successive oxidation of the metal centers.

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