Celtisine
[CAS# 91106-25-1]

Identification

• Name: Celtisine
• Synonyms: Celtisine
• Molecular Formula: C₁₈H₁₉NO₄
• Molecular Weight: 313.35
• CAS Registry Number: 91106-25-1
• SMILES: [C@H]14C2=C(CCN1C)C=CC(=C2OC3=C(C=C(C(=C3)O)OC)C4)O
• InChI: 1S/C18H19NO4/c1-19-6-5-10-3-4-13(20)18-17(10)12(19)7-11-8-16(22-2)14(21)9-15(11)23-18/h3-4,8-9,12,20-21H,5-7H2,1-2H3/t12-/m0/s1
• InChIKey: VRFVDWALYCNYTM-LBPRGKRZSA-N

Properties

• Density: 1.314g/cm³ (Cal.)
• Boiling point: 489.777°C at 760 mmHg (Cal.)
• Flash point: 250.008°C (Cal.)