(2S)-2-Amino-3-Buten-1-Ol Benzoate (1:1)
[CAS# 261360-75-2]

Identification

• Name: (2S)-2-Amino-3-Buten-1-Ol Benzoate (1:1)
• Synonyms: (S)-2-Aminobut-3-en-1-ol,benzoate salt; benzoic acid, (2S)-2-aminobut-3-en-1-ol
• Molecular Formula: C₁₁H₁₅NO₃
• Molecular Weight: 209.24
• CAS Registry Number: 261360-75-2
• SMILES: O=C(O)c1ccccc1.OC[C@H](\C=C)N
• InChI: 1S/C7H6O2.C4H9NO/c8-7(9)6-4-2-1-3-5-6;1-2-4(5)3-6/h1-5H,(H,8,9);2,4,6H,1,3,5H2/t;4-/m.0/s1
• InChIKey: HFAZTHPBSQNAFO-VWMHFEHESA-N

Properties

• Boiling point: 249.3°C at 760 mmHg (Cal.)
• Flash point: 111.4°C (Cal.)
• Refractive index: (Cal.)