3-Amino-3-(4-hydroxy-3-nitrophenyl)propanoic acid

Base Information

• Chemical Name: 3-Amino-3-(4-hydroxy-3-nitrophenyl)propanoic acid
• CAS No.: 682803-58-3
• Molecular Formula: C9H10N2O5
• Molecular Weight: 226.19
• DSSTox Substance ID: DTXSID90697302
• Mol file: 682803-58-3.mol

Synonyms:682803-58-3;3-AMINO-3-(4-HYDROXY-3-NITROPHENYL)PROPANOIC ACID;3-AMINO-3-(4-HYDROXY-3-NITRO-PHENYL)-PROPIONIC ACID;DTXSID90697302;EN300-1847393;3-AMINO-3-(4-HYDROXY-3-NITRO-PHENYL)-PROPIONICACID

Chemical Property of 3-Amino-3-(4-hydroxy-3-nitrophenyl)propanoic acid

Chemical Property:

• PSA: 129.37000
• LogP: 1.99840
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 226.05897142
• Heavy Atom Count: 16
• Complexity: 278

Purity/Quality:

99%min ^*data from raw suppliers

3-Amino-3-(4-hydroxy-3-nitro-phenyl)-propionicacid 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C(CC(=O)O)N)[N+](=O)[O-])O