1,2,4-Triazine-3,5(2H,4H)-dione,6-amino- (18802-38-5)

The 6-Amino-1,2,4-triazine-3,5(2H,4H)-dione with the cas number 18802-38-5 is also called 1,2,4-Triazine-3,5(2H,4H)-dione,6-amino-. The IUPAC name is 6-amino-2H-1,2,4-triazine-3,5-dione. Its EINECS registry number is 242-589-9. The molecular formula is C₃H₄N₄O₂. This chemical belongs to the following product categories: (1)Amines; (2)Ring Systems.

The properties of the chemical are: (1)ACD/LogP: -2.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.75; (4)ACD/LogD (pH 7.4): -4.03; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 56.22 Å²; (13)Index of Refraction: 1.891; (14)Molar Refractivity: 26.59 cm³; (15)Molar Volume: 57.5 cm³; (16)Polarizability: 10.54×10^-24cm³; (17)Surface Tension: 126.8 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1C(=N/NC(=O)N1)\N
(2)InChI: InChI=1/C3H4N4O2/c4-1-2(8)5-3(9)7-6-1/h(H2,4,6)(H2,5,7,8,9)
(3)InChIKey: GFJDLRANNRSMCK-UHFFFAOYAJ