1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline

Base Information

• Chemical Name: 1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline
• CAS No.: 56222-75-4
• Molecular Formula: C16H16ClNO7
• Molecular Weight: 369.7537
• DSSTox Substance ID: DTXSID40971644
• Nikkaji Number: J534.963J

Synonyms:1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline;56222-75-4;Proline, 1-((5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxy-;Hydroxyproline ochratoxin A;C16H16ClNO7;DTXSID40971644;LS-118910;1-(5-Chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl)-4-hydroxyproline

Chemical Property of 1-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-4-hydroxyproline

Chemical Property:

• Vapor Pressure: 1.3E-23mmHg at 25°C
• Boiling Point: 749.7°C at 760 mmHg
• Flash Point: 407.2°C
• Density: 1.602g/cm³
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 369.0615295
• Heavy Atom Count: 25
• Complexity: 585

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)N3CC(CC3C(=O)O)O)Cl

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