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| CAS No.: | 404827-75-4 |
|---|---|
| Name: | 6-FLUORO-1H-INDAZOL-3-YLAMINE |
| Molecular Structure: | |
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| Formula: | C7H6FN3 |
| Molecular Weight: | 151.143 |
| Synonyms: | 6-Fluoro-1H-indazol-3-ylamine; |
| Density: | 1.488 g/cm3 |
| Boiling Point: | 379.288 °C at 760 mmHg |
| Flash Point: | 183.187 °C |
| Hazard Symbols: | Xn |
| Risk Codes: | 22 |
| PSA: | 54.70000 |
| LogP: | 1.86540 |
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Specification
This chemical is called 1H-Indazol-3-amine, 6-fluoro-, and its systematic name is 6-fluoro-1H-indazol-3-amine. With the molecular formula of C7H6FN3, its molecular weight is 151.14. The CAS registry number of this chemical is 404827-75-4. Additionally, its product category is Halide.
Other characteristics of the 1H-Indazol-3-amine, 6-fluoro- can be summarised as followings: (1)ACD/LogP: 1.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 50; (8)ACD/KOC (pH 7.4): 50; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.7 Å2; (13)Index of Refraction: 1.737; (14)Molar Refractivity: 40.85 cm3; (15)Molar Volume: 101.585 cm3; (16)Polarizability: 16.194×10-24cm3; (17)Surface Tension: 73.871 dyne/cm; (18)Density: 1.488 g/cm3; (19)Flash Point: 183.187 °C; (20)Enthalpy of Vaporization: 62.729 kJ/mol; (21)Boiling Point: 379.288 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Fc1ccc2c(c1)nnc2N
2.InChI: InChI=1/C7H6FN3/c8-4-1-2-5-6(3-4)10-11-7(5)9/h1-3H,(H3,9,10,11)
3.InChIKey: JKOGFRGFWFEFNT-UHFFFAOYAF