1,4,5,6-Tetrahydro-5-Phenyl-2-Pyrimidinamine Sulfate (2:1)
[CAS# 78534-19-7]

Identification

• Name: 1,4,5,6-Tetrahydro-5-Phenyl-2-Pyrimidinamine Sulfate (2:1)
• Synonyms: 2-Amino-5-Phenyl-1,4,5,6-Tetrahydropyrimidine Hemisulfate; 2-Pyrimidinamine, 1,4,5,6-Tetrahydro-5-Phenyl-, Sulfate (2:1)
• Molecular Formula: C₂₀H₂₈N₆O₄S
• Molecular Weight: 448.54
• CAS Registry Number: 78534-19-7
• SMILES: O=[S](=O)(O)O.C2=C(C1CN=C(NC1)N)C=CC=C2.C4=C(C3CN=C(NC3)N)C=CC=C4
• InChI: 1S/2C10H13N3.H2O4S/c2*11-10-12-6-9(7-13-10)8-4-2-1-3-5-8;1-5(2,3)4/h2*1-5,9H,6-7H2,(H3,11,12,13);(H2,1,2,3,4)
• InChIKey: MSRXHWUJBWNPBJ-UHFFFAOYSA-N

Properties

• Boiling point: 327.5°C at 760 mmHg (Cal.)
• Flash point: 151.9°C (Cal.)