1-Arabinofuranosyl-2-Thiocytosine
[CAS# 28419-39-8]

Identification

• Name: 1-Arabinofuranosyl-2-Thiocytosine
• Synonyms: 4-Amino-1-[(2R,3S,4S,5R)-2,3,4-Trihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Pyrimidine-2-Thione Hydrochloride; 4-Amino-1-[(2R,3S,4S,5R)-2,3,4-Trihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-2-Pyrimidinethione Hydrochloride; 4-Amino-1-[(2R,3S,4S,5R)-2,3,4-Trihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]Pyrimidine-2-Thione Hydrochloride
• Molecular Formula: C₉H₁₄ClN₃O₅S
• Molecular Weight: 311.74
• CAS Registry Number: 28419-39-8
• SMILES: [C@@H]1(O)[C@](O[C@@H]([C@H]1O)CO)(O)N2C=CC(=NC2=S)N.[H+].[Cl-]
• InChI: 1S/C9H13N3O5S.ClH/c10-5-1-2-12(8(18)11-5)9(16)7(15)6(14)4(3-13)17-9;/h1-2,4,6-7,13-16H,3H2,(H2,10,11,18);1H/t4-,6-,7+,9-;/m1./s1
• InChIKey: RCWYXGAOCMUXHG-ZXBIKLPVSA-N

Properties

• Boiling point: 560°C at 760 mmHg (Cal.)
• Flash point: 292.5°C (Cal.)