5-Iodo-1,7-Dihydro-4H-Pyrrolo[2,3-d]Pyrimidin-4-One
[CAS# 135352-71-5]

Identification

• Name: 5-Iodo-1,7-Dihydro-4H-Pyrrolo[2,3-d]Pyrimidin-4-One
• Synonyms: "5-IODO-3,7-DIHYDRO-PYRROLO[2,3-D]PYRIMIDIN-4-ONE"; 3,7-Dihydro-5-iodo-4H-pyrrolo[2,3-d]pyrimidin-4-one; 3,7-Dihydro-5-iodo-4-oxo-4H-pyrrolo[2,3-d]pyrimidine
• Molecular Formula: C₆H₄IN₃O
• Molecular Weight: 261.02
• CAS Registry Number: 135352-71-5
• SMILES: Ic1cnc2N\C=N/C(=O)c12
• InChI: 1S/C6H4IN3O/c7-3-1-8-5-4(3)6(11)10-2-9-5/h1-2H,(H2,8,9,10,11)
• InChIKey: QHYIUMOXLCMESH-UHFFFAOYSA-N

Properties

• Density: 2.584g/cm³ (Cal.)
• Boiling point: 470.987°C at 760 mmHg (Cal.)
• Flash point: 238.645°C (Cal.)
• Refractive index: 1.92 (Cal.)

Safety Data

• Safety Description: Harmful/Irritant/Keep Cold