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Name	2-Bromo-7-iodo-5H-pyrrolo[2,3-b]pyrazine	EINECS	N/A
CAS No.	875781-44-5	Density	2.559g/cm³
PSA	N/A	LogP	N/A
Solubility	N/A	Melting Point	N/A
Formula	C₆H₃BrIN₃	Boiling Point	311℃
Molecular Weight	323.918	Flash Point	142℃
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	4H-Pyrrolo[2,3-b]pyrazine,2-bromo-7-iodo- (9CI);2-Bromo-7-iodo-5H-pyrrolo[2,3-b]pyrazine;2-Bromo-7-iodo-5H-pyrrolo[3,2-b]pyrazine;	Article Data	7

2-Bromo-7-iodo-5H-pyrrolo[2,3-b]pyrazine Specification

The 2-Bromo-7-iodo-5H-pyrrolo[2,3-b]pyrazine, with CAS registry number 875781-44-5, belongs to the following product category: Chiral Chemicals. It has the systematic name of 2-bromo-7-iodo-5H-pyrrolo[2,3-b]pyrazine. And the chemical formula of this chemical is C₆H₃BrIN₃.

Physical properties of 2-Bromo-7-iodo-5H-pyrrolo[2,3-b]pyrazine: (1)ACD/LogP: 3.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.07; (4)ACD/LogD (pH 7.4): 3.06; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 41.57 Å²; (9)Index of Refraction: 1.824; (10)Molar Refractivity: 55.3 cm³; (11)Molar Volume: 126.5 cm³; (12)Polarizability: 21.92×10^-24cm³; (13)Surface Tension: 85.6 dyne/cm; (14)Density: 2.559 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cnc2ncc(I)c2n1
(2)InChI: InChI=1/C6H3BrIN3/c7-4-2-10-6-5(11-4)3(8)1-9-6/h1-2H,(H,9,10)
(3)InChIKey: ULGMTONBTOMHOK-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C6H3BrIN3/c7-4-2-10-6-5(11-4)3(8)1-9-6/h1-2H,(H,9,10)
(5)Std. InChIKey: ULGMTONBTOMHOK-UHFFFAOYSA-N

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