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Basic Information
CAS No.: 459133-66-5
Name: 5-BROMO-3-IODO (1H)INDAZOLE
Article Data: 23
Molecular Structure:
Molecular Structure of 459133-66-5 (5-BROMO-3-IODO (1H)INDAZOLE)
Formula: C7H4 Br I N2
Molecular Weight: 322.931
Synonyms: 5-Bromo-3-iodo-1H-indazole
Density: 2.421g/cm3
Melting Point: 196 °C(Solv: ligroine (8032-32-4))
Boiling Point: 413.1oC at 760 mmHg
Flash Point: 203.6oC
PSA: 28.68000
LogP: 2.93000
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Chemistry

Molecule structure of 5-Bromo-3-iodo-1H-indazole (CAS NO.459133-66-5):

Systematic Name: 5-Bromo-3-iodo-1H-indazole
Molecular Formula: C7H4BrIN2
Molecular Weight: 322.93 g/mol
CAS Registry Number: 459133-66-5 
Index of Refraction: 1.804
Molar Refractivity: 57.21 cm3
Molar Volume: 133.3 cm3
Polarizability: 22.68×10-24 cm3
Surface Tension: 73.8 dyne/cm
Density: 2.421 g/cm3
Flash Point: 203.6 °C
Enthalpy of Vaporization: 63.99 kJ/mol
Boiling Point: 413.1 °C at 760 mmHg
Vapour Pressure: 1.18E-06 mmHg at 25 °C
SMILES: Brc1cc2c(cc1)nnc2I
InChI: InChI=1/C7H4BrIN2/c8-4-1-2-6-5(3-4)7(9)11-10-6/h1-3H,(H,10,11)
InChIKey: IBFAYUXCRDDBRD-UHFFFAOYAU
Std. InChI: InChI=1S/C7H4BrIN2/c8-4-1-2-6-5(3-4)7(9)11-10-6/h1-3H,(H,10,11)
Std. InChIKey of 5-Bromo-3-iodo-1H-indazole (CAS NO.459133-66-5): IBFAYUXCRDDBRD-UHFFFAOYSA-N

Specification

 5-Bromo-3-iodo-1H-indazole (CAS NO.459133-66-5) is also named as 1H-Indazole,5-bromo-3-iodo- .