Penta-s-triazinetrione
[CAS# 30622-37-8]

Identification

• Name: Penta-s-triazinetrione
• Synonyms: Potassium; 1,5-Dichloro-4,6-Diketo-S-Triazin-2-Olate; 1,3,5-Trichloro-1,3,5-Triazinane-2,4,6-Trione; 1,3,5-Triazine-2,4,6(1H,3H,5H)-Trione, 1,3,5-Trichloro-, Mixt. With 1,3-Dichloro-1,3,5-Triazine-2,4,6(1H,3H,5H)-Trione Potassium Salt; Penta-S-Triazinetrione
• Molecular Formula: C₆Cl₅KN₆O₆
• Molecular Weight: 468.47
• CAS Registry Number: 30622-37-8
• SMILES: [N-]1C(=O)N(Cl)C(=O)N(Cl)C1=O.O=C2N(Cl)C(=O)N(Cl)C(=O)N2Cl.[K+]
• InChI: 1S/C3Cl3N3O3.C3HCl2N3O3.K/c4-7-1(10)8(5)3(12)9(6)2(7)11;4-7-1(9)6-2(10)8(5)3(7)11;/h;(H,6,9,10);/q;;+1/p-1
• InChIKey: PKUZBZHKZBYTJJ-UHFFFAOYSA-M

Properties

• Boiling point: 272.3°C at 760 mmHg (Cal.)
• Flash point: 118.5°C (Cal.)