4-Amino-2-oxo-3,5-heptadienedioic acid

Base Information

• Chemical Name: 4-Amino-2-oxo-3,5-heptadienedioic acid
• CAS No.: 151028-44-3
• Molecular Formula: C7H7 N O5
• Molecular Weight: 185.13
• Mol file: 151028-44-3.mol

Synonyms:4-amino-2-oxo-3,5-heptadienedioic acid;4-amino-2-oxo-3,5-heptadienedioic acid, (Z,E)-isomer;4-amino-6-carboxy-2-oxohexa-3,5-dienoate;ACOHDA

Chemical Property of 4-Amino-2-oxo-3,5-heptadienedioic acid

Chemical Property:

• Vapor Pressure: 4.02E-06mmHg at 25°C
• Boiling Point: 358.9°Cat760mmHg
• Flash Point: 170.9°C
• PSA: 0.00000
• Density: 1.527g/cm³
• LogP: 0.00000
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 185.03242232
• Heavy Atom Count: 13
• Complexity: 302

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C(=CC(=O)O)C(=CC(=O)C(=O)O)N
• Isomeric SMILES: C(=C/C(=O)O)\C(=C/C(=O)C(=O)O)\N

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