Home >> Chemicals Listing >> hot product list by 1  

1H-Indazole,5-bromo-6-fluoro- (105391-70-6)

Identification
Name:1H-Indazole,5-bromo-6-fluoro-
Synonyms:5-Bromo-6-fluoro-1H-indazole
CAS:105391-70-6
Molecular Formula: C7H4 Br F N2
Molecular Weight: 0
InChI: InChI=1/C7H4BrFN2/c8-5-1-4-3-10-11-7(4)2-6(5)9/h1-3H,(H,10,11)
Molecular Structure: (C7H4BrFN2) 5-Bromo-6-fluoro-1H-indazole
Properties
Density:1.861
Refractive index:1.693
Specification:

The CAS register number of 5-Bromo-6-fluoro-1H-indazole is 105391-70-6. It also can be called as 1H-Indazole,5-bromo-6-fluoro- and the systematic name about this chemical is 5-bromo-6-fluoro-1H-indazole.

Physical properties about 5-Bromo-6-fluoro-1H-indazole are: (1)ACD/LogP: 2.19; (2)ACD/LogD (pH 5.5): 2.194; (3)ACD/LogD (pH 7.4): 2.194; (4)ACD/BCF (pH 5.5): 27.393; (5)ACD/BCF (pH 7.4): 27.392; (6)ACD/KOC (pH 5.5): 372.115; (7)ACD/KOC (pH 7.4): 372.106; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 28.68Å2; (11)Index of Refraction: 1.693; (12)Molar Refractivity: 44.304 cm3; (13)Molar Volume: 115.49 cm3; (14)Polarizability: 17.563x10-24cm3; (15)Surface Tension: 60.79 dyne/cm; (16)Enthalpy of Vaporization: 55.213 kJ/mol; (17)Boiling Point: 332.199 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2cn[nH]c2cc(c1Br)F
(2)InChI: InChI=1/C7H4BrFN2/c8-5-1-4-3-10-11-7(4)2-6(5)9/h1-3H,(H,10,11)
(3)InChIKey: ZNNFNEIFQIAWNY-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C7H4BrFN2/c8-5-1-4-3-10-11-7(4)2-6(5)9/h1-3H,(H,10,11)
(5)Std. InChIKey: ZNNFNEIFQIAWNY-UHFFFAOYSA-N

Safety Data