3-Isoxazolepropanoic acid, alpha-amino-, (S)-

Base Information

• Chemical Name: 3-Isoxazolepropanoic acid, alpha-amino-, (S)-
• CAS No.: 189215-63-2
• Molecular Formula: C6H8 N2 O3
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID50443185
• Nikkaji Number: J831.731C
• Wikidata: Q82260897
• Mol file: 189215-63-2.mol

Synonyms:189215-63-2;3-ISOXAZOLEPROPANOIC ACID, ALPHA-AMINO-, (S)-;(2S)-2-amino-3-(1,2-oxazol-3-yl)propanoic Acid;3-Isoxazolepropanoicacid,alpha-amino-,(S)-(9CI);(S)-2-amino-3-(isoxazol-3-yl)propanoic acid;3-(Isoxazol-3-yl)-L-alanine;SCHEMBL13957336;DTXSID50443185;(S)-2-amino-3-(isoxazol-3-yl)propanoicacid

Chemical Property of 3-Isoxazolepropanoic acid, alpha-amino-, (S)-

Chemical Property:

• PSA: 89.35000
• LogP: 0.32930
• XLogP3: -2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 156.05349212
• Heavy Atom Count: 11
• Complexity: 151

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CON=C1CC(C(=O)O)N
• Isomeric SMILES: C1=CON=C1C[C@@H](C(=O)O)N

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