3-Amino-4-(4-isopropyl-benzyl)-pentanoic acid

Base Information

• Chemical Name: 3-Amino-4-(4-isopropyl-benzyl)-pentanoic acid
• CAS No.: 773122-75-1
• Molecular Formula: C15H23 N O2
• Molecular Weight: 249.35
• DSSTox Substance ID: DTXSID90697342
• Mol file: 773122-75-1.mol

Synonyms:773122-75-1;3-AMINO-4-(4-ISOPROPYL-BENZYL)-PENTANOIC ACID;3-amino-4-methyl-5-(4-propan-2-ylphenyl)pentanoic acid;DTXSID90697342;3-AMINO-4-(4-ISOPROPYL-BENZYL)-PENTANOICACID;3-Amino-4-methyl-5-[4-(propan-2-yl)phenyl]pentanoic acid

Chemical Property of 3-Amino-4-(4-isopropyl-benzyl)-pentanoic acid

Chemical Property:

• Boiling Point: 403.7±45.0 °C(Predicted)
• PKA: 3.77±0.10(Predicted)
• PSA: 63.32000
• Density: 1.050±0.06 g/cm3(Predicted)
• LogP: 3.49090
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 249.172878976
• Heavy Atom Count: 18
• Complexity: 257

Purity/Quality:

99%min ^*data from raw suppliers

3-Amino-4-(4-isopropyl-benzyl)-pentanoicacid 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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