Siderochelin A

Base Information

• Chemical Name: Siderochelin A
• CAS No.: 77550-87-9
• Molecular Formula: C11H13 N3 O3
• Molecular Weight: 235.24
• Wikidata: Q104394614,Q105246039
• Metabolomics Workbench ID: 98247

Synonyms:2H-Pyrrole-2-carboxamide, 3,4-dihydro-4-hydroxy-5-(3-hydroxy-2-pyridinyl)-4-methyl-, trans-(+)-;siderochelin A

Chemical Property of Siderochelin A

Chemical Property:

• Vapor Pressure: 3.41E-14mmHg at 25°C
• Boiling Point: 545.9°C at 760 mmHg
• Flash Point: 284°C
• PSA: 105.77000
• Density: 1.51g/cm³
• LogP: -0.08000
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 235.09569129
• Heavy Atom Count: 17
• Complexity: 358

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(N=C1C2=C(C=CC=N2)O)C(=O)N)O
• Isomeric SMILES: C[C@]1(CC(N=C1C2=C(C=CC=N2)O)C(=O)N)O

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