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Bruceanol C

Base Information
  • Chemical Name:Bruceanol C
  • CAS No.:114586-21-9
  • Molecular Formula:C31H38 O13
  • Molecular Weight:618.63
  • Hs Code.:
  • DSSTox Substance ID:DTXSID401336733
  • Wikipedia:Bruceanol C,Bruceanol_C
  • Wikidata:Q105091116
  • NCI Thesaurus Code:C1768
  • Mol file:114586-21-9.mol
Bruceanol C

Synonyms:bruceanol C

Suppliers and Price of Bruceanol C
Supply Marketing:
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
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Total 1 raw suppliers
Chemical Property of Bruceanol C
Chemical Property:
  • Vapor Pressure:7.8E-31mmHg at 25°C 
  • Boiling Point:815.9°Cat760mmHg 
  • PKA:5.77±0.70(Predicted) 
  • Flash Point:261.7°C 
  • PSA:200.03000 
  • Density:1.43g/cm3 
  • LogP:-0.23350 
  • XLogP3:0
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:13
  • Rotatable Bond Count:8
  • Exact Mass:618.23124126
  • Heavy Atom Count:44
  • Complexity:1420
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1=CC(=O)C(C2(C1CC3C45C2C(C(C(C4C(C(=O)O3)C(=O)C(=O)C=C(C)C(C)(C)OC(=O)C)(OC5)C(=O)OC)O)O)C)O
  • Isomeric SMILES:CC1=CC(=O)[C@H]([C@]2([C@H]1C[C@@H]3C45[C@@H]2[C@H]([C@@H]([C@@]([C@@H]4[C@H](C(=O)O3)C(=O)C(=O)/C=C(\C)/C(C)(C)OC(=O)C)(OC5)C(=O)OC)O)O)C)O
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