1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-4-(Octadecylamino)Pyrimidin-2-One
[CAS# 158233-67-1]

Identification

• Name: 1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-4-(Octadecylamino)Pyrimidin-2-One
• Synonyms: 1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-4-(Octadecylamino)Pyrimidin-2-One; 1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-4-(Octadecylamino)-2-Pyrimidinone; 1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-4-(Stearylamino)Pyrimidin-2-One
• Molecular Formula: C₂₇H₄₉N₃O₅
• Molecular Weight: 495.70
• CAS Registry Number: 158233-67-1
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@@H]1O)CO)N2C(=O)N=C(NCCCCCCCCCCCCCCCCCC)C=C2
• InChI: 1S/C27H49N3O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-28-23-18-20-30(27(34)29-23)26-25(33)24(32)22(21-31)35-26/h18,20,22,24-26,31-33H,2-17,19,21H2,1H3,(H,28,29,34)/t22-,24-,25+,26-/m1/s1
• InChIKey: HQHQCEKUGWOYPS-URBBEOKESA-N

Properties

• Density: 1.167g/cm³ (Cal.)
• Boiling point: 643.04°C at 760 mmHg (Cal.)
• Flash point: 342.699°C (Cal.)