Aldol-histidine

Base Information

• Chemical Name: Aldol-histidine
• CAS No.: 38964-85-1
• Molecular Formula: C18H31N5O6
• Molecular Weight: 413.4686
• DSSTox Substance ID: DTXSID90959811
• Mol file: 38964-85-1.mol

Synonyms:aldol-histidine

Chemical Property of Aldol-histidine

Chemical Property:

• Vapor Pressure: 1.14E-28mmHg at 25°C
• Boiling Point: 822.9°Cat760mmHg
• Flash Point: 451.5°C
• Density: 1.354g/cm³
• XLogP3: -6.7
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 15
• Exact Mass: 413.22743373
• Heavy Atom Count: 29
• Complexity: 549

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(NC=N1)CC(C(=O)C(CCCC(C(=O)O)N)C(CCC(C(=O)O)N)CO)N

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