4-Chloro-7-(Phenylsulfonyl)-7H-Pyrrolo[2,3-d]Pyrimidine
[CAS# 186519-89-1]

Identification

• Name: 4-Chloro-7-(Phenylsulfonyl)-7H-Pyrrolo[2,3-d]Pyrimidine
• Synonyms: 4-chloro-7-(phenylsulfonyl)-7H-pyrrolo[2,3-d]pyrimidine; 4-Chloro-7-phenylsulfonyl-7H-pyrrolo[2,3-d]pyrimidine; 7-(Benzenesulfonyl)-4-chloropyrrolo[2,3-d]pyrimidine
• Molecular Formula: C₁₂H₈ClN₃O₂S
• Molecular Weight: 293.73
• CAS Registry Number: 186519-89-1
• SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2N=CN=C3Cl
• InChI: 1S/C12H8ClN3O2S/c13-11-10-6-7-16(12(10)15-8-14-11)19(17,18)9-4-2-1-3-5-9/h1-8H
• InChIKey: HPWMGRLPNPQCQX-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 502.4±53.0°C at 760 mmHg (Cal.)
• Flash point: 257.6±30.9°C (Cal.)
• Refractive index: 1.714 (Cal.)