1H-Indazole-3,7-dicarbonitrile,1-methyl- supplier

Name
1H-INDAZOLE-3,7-DICARBONITRILE, 1-METHYL-
EINECS
CAS No. 256228-69-0
Density 1.25 g/cm³
Solubility
Melting Point
Formula C₁₀H₆N₄
Boiling Point 406.7 °C at 760 mmHg
Molecular Weight 182.18
Flash Point 199.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Methyl-3,7-indazoledicarbonitrile;1-Methyl-1H-indazole-3,7-dicarbonitrile;1-methyl-1H-indazole-3,7-dicarbonitrile;1-methyl-1H-indazole-3,7-dicarbonitrile;
PSA 65.40000
LogP 1.31666

1H-Indazole-3,7-dicarbonitrile,1-methyl- Specification

The 1H-Indazole-3,7-dicarbonitrile,1-methyl-, with the CAS registry number 256228-69-0, has the systmatic name of 1-Methyl-1H-indazole-3,7-dicarbonitrile. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of this chemical is C₁₀H₆N₄.

The physical properties of 1H-Indazole-3,7-dicarbonitrile,1-methyl- are as following: (1)ACD/LogP: 0.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.8; (4)ACD/LogD (pH 7.4): 0.8; (5)ACD/BCF (pH 5.5): 2.4; (6)ACD/BCF (pH 7.4): 2.4; (7)ACD/KOC (pH 5.5): 65.16; (8)ACD/KOC (pH 7.4): 65.16; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 65.4 Å²; (13)Index of Refraction: 1.671; (14)Molar Refractivity: 54.18 cm³; (15)Molar Volume: 144.7 cm³; (16)Polarizability: 21.48×10^-24cm³; (17)Surface Tension: 53.5 dyne/cm; (18)Density: 1.25 g/cm³; (19)Flash Point: 199.8 °C; (20)Enthalpy of Vaporization: 65.85 kJ/mol; (21)Boiling Point: 406.7 °C at 760 mmHg; (22)Vapour Pressure: 7.99E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cn1c2c(cccc2c(n1)C#N)C#N
(2)InChI: InChI=1/C10H6N4/c1-14-10-7(5-11)3-2-4-8(10)9(6-12)13-14/h2-4H,1H3
(3)InChIKey: NPCGIZHLEMNAFE-UHFFFAOYAE

Product Name

1H-INDAZOLE-3,7-DICARBONITRILE, 1-METHYL-

1H-Indazole-3,7-dicarbonitrile,1-methyl- Specification

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