3-Amino-3-[3-(4-tert-butylphenoxy)phenyl]propanoic acid

Base Information

• Chemical Name: 3-Amino-3-[3-(4-tert-butylphenoxy)phenyl]propanoic acid
• CAS No.: 773125-02-3
• Molecular Formula: C19H23 N O3
• Molecular Weight: 313.39
• DSSTox Substance ID: DTXSID30697321
• Mol file: 773125-02-3.mol

Synonyms:773125-02-3;3-amino-3-[3-(4-tert-butylphenoxy)phenyl]propanoic acid;DTXSID30697321;3-AMINO-3-[3-(4-TERT-BUTYL-PHENOXY)-PHENYL]-PROPIONICACID

Chemical Property of 3-Amino-3-[3-(4-tert-butylphenoxy)phenyl]propanoic acid

Chemical Property:

• Boiling Point: 454.5±45.0 °C(Predicted)
• PKA: 3.66±0.10(Predicted)
• PSA: 72.55000
• Density: 1.139±0.06 g/cm3(Predicted)
• LogP: 4.95120
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 313.16779360
• Heavy Atom Count: 23
• Complexity: 383

Purity/Quality:

99%min ^*data from raw suppliers

3-Amino-3-[3-(4-tert-butyl-phenoxy)-phenyl]-propionicacid 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)OC2=CC=CC(=C2)C(CC(=O)O)N