CAS No.709046-14-0,1H-Indazol-5-amine,6-fluoro-(9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	709046-14-0
Name:	1H-Indazol-5-amine,6-fluoro-(9CI)
Article Data:	3

Formula:	C₇H₆FN₃
Molecular Weight:	151.143
Synonyms:	5-Amino-6-fluoroindazole;6-Fluoro-1H-indazol-5-amine;
Density:	1.488g/cm³
Boiling Point:	358.374 °C at 760 mmHg
Flash Point:	170.539 °C
PSA:	54.70000
LogP:	1.86540

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Specification

The 1H-Indazol-5-amine,6-fluoro-, with CAS registry number 709046-14-0, belongs to the following product categories: (1)Halide; (2)Chiral Chemicals. It has the systematic name of 6-fluoro-1H-indazol-5-amine. And its IUPAC name is the same one. The chemical formula of this chemical is C₇H₆FN₃.

Physical properties of 1H-Indazol-5-amine,6-fluoro-: (1)ACD/LogP: 1.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.058; (4)ACD/LogD (pH 7.4): 1.059; (5)ACD/BCF (pH 5.5): 3.753; (6)ACD/BCF (pH 7.4): 3.756; (7)ACD/KOC (pH 5.5): 89.668; (8)ACD/KOC (pH 7.4): 89.74; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (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: 170.539 °C; (20)Enthalpy of Vaporization: 60.385 kJ/mol; (21)Boiling Point: 358.374 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2cn[nH]c2cc(c1N)F
(2)InChI: InChI=1/C7H6FN3/c8-5-2-7-4(1-6(5)9)3-10-11-7/h1-3H,9H2,(H,10,11)
(3)InChIKey: GQKYKPLGNBXERW-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C7H6FN3/c8-5-2-7-4(1-6(5)9)3-10-11-7/h1-3H,9H2,(H,10,11)
(5)Std. InChIKey: GQKYKPLGNBXERW-UHFFFAOYSA-N