(S)-2-Amino-3-(1H-indol-2-yl)propanoic acid

Base Information

• Chemical Name: (S)-2-Amino-3-(1H-indol-2-yl)propanoic acid
• CAS No.: 533-42-6
• Molecular Formula: C11H12N2O2
• Molecular Weight: 204.228
• Metabolomics Workbench ID: 94766
• Nikkaji Number: J221.281A
• Wikidata: Q105147807
• Mol file: 533-42-6.mol

Synonyms:(S)-2-amino-3-(1H-indol-2-yl)propanoic acid;isotryptophan

Chemical Property of (S)-2-Amino-3-(1H-indol-2-yl)propanoic acid

Chemical Property:

• PSA: 79.11000
• LogP: 1.82260
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 204.089877630
• Heavy Atom Count: 15
• Complexity: 245

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(N2)CC(C(=O)O)N
• Isomeric SMILES: C1=CC=C2C(=C1)C=C(N2)C[C@@H](C(=O)O)N