Carbocyclic Inosine Monophosphate
[CAS# 97727-48-5]

Identification

• Name: Carbocyclic Inosine Monophosphate
• Synonyms: [(1R,2R,3S,4R)-2,3-Dihydroxy-4-(6-Keto-3H-Purin-9-Yl)Cyclopentyl]Methyl Dihydrogen Phosphate; 6H-Purin-6-One, 9-(2,3-Dihydroxy-4-((Phosphonoxy)Methyl)Cyclopentyl)-1,9-Dihydro-, (1R-(1Alpha,2Beta,3Beta,4Alpha))-; Cc-Imp
• Molecular Formula: C₁₁H₁₅N₄O₇P
• Molecular Weight: 346.24
• CAS Registry Number: 97727-48-5
• SMILES: [C@@H]3([N]1C2=C(N=C1)C(=O)N=CN2)C[C@@H]([C@@H](O)[C@H]3O)CO[P](O)(O)=O
• InChI: 1S/C11H15N4O7P/c16-8-5(2-22-23(19,20)21)1-6(9(8)17)15-4-14-7-10(15)12-3-13-11(7)18/h3-6,8-9,16-17H,1-2H2,(H,12,13,18)(H2,19,20,21)/t5-,6-,8-,9+/m1/s1
• InChIKey: JAVFUCJXWJDPGZ-GCXDCGAKSA-N

Properties

• Density: 2.167g/cm³ (Cal.)
• Boiling point: 764.119°C at 760 mmHg (Cal.)
• Flash point: 415.924°C (Cal.)