4-Bromo-1H-pyrazolo[3,4-c]pyridine supplier

Name
4-Bromo-1H-pyrazolo[3,4-c]pyridine
EINECS
CAS No. 1032943-43-3
Article Data3
CAS DataBase
Density 1.895 g/cm³
Solubility
Melting Point
Formula C₆H₄BrN₃
Boiling Point 357.531 °C at 760 mmHg
Molecular Weight 198.022
Flash Point 170.029 °C
Transport Information
Appearance white solid
Safety 45
Risk Codes 25
Molecular Structure
Hazard Symbols T
Synonyms 1H-pyrazolo[3,4-c]pyridine, 4-bromo-;
PSA 41.57000
LogP 1.72040

4-Bromo-1H-pyrazolo[3,4-c]pyridine Specification

The 4-Bromo-1H-pyrazolo[3,4-c]pyridine, with the CAS registry number 1032943-43-3, is also known as 1H-pyrazolo[3,4-c]pyridine, 4-bromo-. This chemical's molecular formula is C₆H₄BrN₃ and molecular weight is 198.02. What's more, its systematic name is 4-bromo-1H-pyrazolo[3,4-c]pyridine.

Physical properties of 4-Bromo-1H-pyrazolo[3,4-c]pyridine are: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.09; (4)ACD/LogD (pH 7.4): 2.109; (5)ACD/BCF (pH 5.5): 22.549; (6)ACD/BCF (pH 7.4): 23.56; (7)ACD/KOC (pH 5.5): 319.241; (8)ACD/KOC (pH 7.4): 333.546; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.57 Å²; (13)Index of Refraction: 1.746; (14)Molar Refractivity: 42.401 cm³; (15)Molar Volume: 104.504 cm³; (16)Polarizability: 16.809×10^-24 cm³; (17)Surface Tension: 76.935 dyne/cm; (18)Density: 1.895 g/cm³; (19)Flash Point: 170.029 °C; (20)Enthalpy of Vaporization: 57.915 kJ/mol; (21)Boiling Point: 357.531 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2c(cncc2Br)[nH]n1
(2)InChI: InChI=1/C6H4BrN3/c7-5-2-8-3-6-4(5)1-9-10-6/h1-3H,(H,9,10)
(3)InChIKey: KFGSMEJCZZYNNG-UHFFFAOYAH

Product Name

4-Bromo-1H-pyrazolo[3,4-c]pyridine

4-Bromo-1H-pyrazolo[3,4-c]pyridine Specification

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