1H-Indazole,4,6-dinitro- supplier

Name
4,6-DINITRO-1H-INDAZOLE
EINECS
CAS No. 62969-01-1
Density 1.752 g/cm³
Solubility
Melting Point
Formula C₇H₄N₄O₄
Boiling Point 455.3 °C at 760 mmHg
Molecular Weight 208.133
Flash Point 229.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4,6-Dinitro-1H-indazole;
PSA 120.32000
LogP 2.42570

1H-Indazole,4,6-dinitro- Specification

The 1H-Indazole,4,6-dinitro-, with the CAS registry number 62969-01-1. This chemical's molecular formula is C₇H₄N₄O₄ and molecular weight is 208.13. What's more, its systematic name is 4,6-Dinitro-1H-indazole.

Physical properties of 1H-Indazole,4,6-dinitro- are: (1)ACD/LogP: 1.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.73; (4)ACD/LogD (pH 7.4): 1.66; (5)ACD/BCF (pH 5.5): 12.09; (6)ACD/BCF (pH 7.4): 10.3; (7)ACD/KOC (pH 5.5): 207.05; (8)ACD/KOC (pH 7.4): 176.51; (9)#H bond acceptors: 8; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 109.46 Å²; (13)Index of Refraction: 1.777; (14)Molar Refractivity: 49.71 cm³; (15)Molar Volume: 118.7 cm³; (16)Polarizability: 19.7×10^-24 cm³; (17)Surface Tension: 100.2 dyne/cm; (18)Density: 1.752 g/cm³; (19)Flash Point: 229.1 °C; (20)Enthalpy of Vaporization: 68.75 kJ/mol; (21)Boiling Point: 455.3 °C at 760 mmHg; (22)Vapour Pressure: 4.82E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(cc2c1cnn2)[N+]([O-])=O
(2)InChI: InChI=1/C7H4N4O4/c12-10(13)4-1-6-5(3-8-9-6)7(2-4)11(14)15/h1-3H,(H,8,9)
(3)InChIKey: XDUJSJUGOHAQFZ-UHFFFAOYAY

Product Name

4,6-DINITRO-1H-INDAZOLE

1H-Indazole,4,6-dinitro- Specification

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