8-(4-Chlorophenylthio)guanosine-3',5'-cyclic monophosphate
[CAS# 54364-02-2]

Identification

• Name: 8-(4-Chlorophenylthio)guanosine-3',5'-cyclic monophosphate
• Synonyms: 2-Amino-8-[(4-Chlorophenyl)Thio]-9-[(1S,6R,8R,9R)-3,9-Dihydroxy-3-Oxo-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-8-Yl]-3H-Purin-6-One; 2-Amino-8-[(4-Chlorophenyl)Thio]-9-[(1S,6R,8R,9R)-3,9-Dihydroxy-3-Keto-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-8-Yl]-3H-Purin-6-One; 8-((4-Chlorophenyl)Thio)Cyclic-3',5'-Gmp
• Molecular Formula: C₁₆H₁₅ClN₅O₇PS
• Molecular Weight: 487.81
• CAS Registry Number: 54364-02-2
• SMILES: [C@@H]15O[P](OC[C@H]1O[C@@H]([N]2C4=C(N=C2SC3=CC=C(Cl)C=C3)C(=O)N=C(N4)N)[C@@H]5O)(=O)O
• InChI: 1S/C16H15ClN5O7PS/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(28-14)5-27-30(25,26)29-11/h1-4,8,10-11,14,23H,5H2,(H,25,26)(H3,18,20,21,24)/t8-,10-,11-,14-/m1/s1
• InChIKey: ZDJHIEHUVPCEDK-IDTAVKCVSA-N

Properties

• Density: 2.198g/cm³ (Cal.)
• Boiling point: 841.798°C at 760 mmHg (Cal.)
• Flash point: 462.903°C (Cal.)