2-[2-[Carboxymethyl-[(3-hydroxyphenyl)methyl]amino]ethyl-[(3-hydroxyphenyl)methyl]amino]acetic acid

Base Information

• Chemical Name: 2-[2-[Carboxymethyl-[(3-hydroxyphenyl)methyl]amino]ethyl-[(3-hydroxyphenyl)methyl]amino]acetic acid
• CAS No.: 158069-80-8
• Molecular Formula: C20H24N2O6
• Molecular Weight: 388.41400
• DSSTox Substance ID: DTXSID00578830
• Wikidata: Q82469158

Synonyms:158069-80-8;2-[2-[carboxymethyl-[(3-hydroxyphenyl)methyl]amino]ethyl-[(3-hydroxyphenyl)methyl]amino]acetic acid;SCHEMBL6674551;DTXSID00578830

Chemical Property of 2-[2-[Carboxymethyl-[(3-hydroxyphenyl)methyl]amino]ethyl-[(3-hydroxyphenyl)methyl]amino]acetic acid

Chemical Property:

• Boiling Point: 638.1±55.0 °C(Predicted)
• PSA: 121.54000
• Density: 1.374±0.06 g/cm3(Predicted)
• LogP: 1.57120
• XLogP3: -2.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 11
• Exact Mass: 388.16343649
• Heavy Atom Count: 28
• Complexity: 459

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)O)CN(CCN(CC2=CC(=CC=C2)O)CC(=O)O)CC(=O)O

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