2-[(2S)-2-Butanylamino]-1,3-thiazole-5-carboxylic acid
[CAS# 745077-98-9]

Identification

• Name: 2-[(2S)-2-Butanylamino]-1,3-thiazole-5-carboxylic acid
• Synonyms: (S)-2-(sec-butylamino)thiazole-5-carboxylic acid
• Molecular Formula: C₈H₁₂N₂O₂S
• Molecular Weight: 200.26
• CAS Registry Number: 745077-98-9
• SMILES: CC[C@H](C)Nc1ncc(s1)C(=O)O
• InChI: 1S/C8H12N2O2S/c1-3-5(2)10-8-9-4-6(13-8)7(11)12/h4-5H,3H2,1-2H3,(H,9,10)(H,11,12)/t5-/m0/s1
• InChIKey: MFOLIAOJCSDWNO-YFKPBYRVSA-N

Properties

• Density: 1.3g/cm³ (Cal.)
• Boiling point: 347.009°C at 760 mmHg (Cal.)
• Flash point: 163.666°C (Cal.)
• Refractive index: 1.606 (Cal.)