Otonecine
[CAS# 6887-34-9]

Identification

• Name: Otonecine
• Synonyms: (4R,6Z)-4-Hydroxy-1-Methyl-6-Methylol-2,3,4,8-Tetrahydroazocin-5-One; 1H-Pyrrolizinium,2,3,5,7A-Tetrahydro-1,7A-Dihydroxy-7-(Hydroxymethyl)-4-Methyl-,(1R-(1Alpha,4Beta,7Abeta))-; C10356
• Molecular Formula: C₉H₁₅NO₃
• Molecular Weight: 185.22
• CAS Registry Number: 6887-34-9
• SMILES: [C@@H]1(O)CCN(C/C=C(C1=O)/CO)C
• InChI: 1S/C9H15NO3/c1-10-4-2-7(6-11)9(13)8(12)3-5-10/h2,8,11-12H,3-6H2,1H3/b7-2-/t8-/m1/s1
• InChIKey: GRAGROPQORVALZ-VKWJFSHESA-N

Properties

• Density: 1.185g/cm³ (Cal.)
• Boiling point: 389.345°C at 760 mmHg (Cal.)
• Flash point: 189.269°C (Cal.)