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54920-83-1

Basic Information
CAS No.: 54920-83-1
Name: 2-bromo-1,7-naphthyridine
Molecular Structure:
Molecular Structure of 54920-83-1 (2-bromo-1,7-naphthyridine)
Formula: C8H5BrN2
Molecular Weight: 209.045
Synonyms: 2-Bromo-1,7-naphthyridine;
Density: 1.657 g/cm3
Boiling Point: 324.912 °C at 760 mmHg
Flash Point: 150.301 °C
PSA: 25.78000
LogP: 2.39230
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Specification

The 1,7-Naphthyridine,2-bromo- is an organic compound with the formula C8H5BrN2. The systematic name of this chemical is 2-bromo-1,7-naphthyridine. With the CAS registry number 54920-83-1, the product's category is Non-Chiral Heterocyclic Compounds.

Physical properties about 1,7-Naphthyridine,2-bromo- are: (1)ACD/LogP: 1.24; (2)ACD/LogD (pH 5.5): 1.235; (3)ACD/LogD (pH 7.4): 1.236; (4)ACD/BCF (pH 5.5): 5.112; (5)ACD/BCF (pH 7.4): 5.118; (6)ACD/KOC (pH 5.5): 111.854; (7)ACD/KOC (pH 7.4): 111.989; (8)#H bond acceptors: 2; (9)Polar Surface Area: 25.78 Å2; (10)Index of Refraction: 1.685; (11)Molar Refractivity: 47.968 cm3; (12)Molar Volume: 126.182 cm3; (13)Polarizability: 19.016×10-24cm3; (14)Surface Tension: 59.127 dyne/cm; (15)Density: 1.657 g/cm3; (16)Flash Point: 150.301 °C; (17)Enthalpy of Vaporization: 54.445 kJ/mol; (18)Boiling Point: 324.912 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(nc2c1ccnc2)Br
(2)InChI: InChI=1/C8H5BrN2/c9-8-2-1-6-3-4-10-5-7(6)11-8/h1-5H
(3)InChIKey: FVJQNINMQYFIEQ-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C8H5BrN2/c9-8-2-1-6-3-4-10-5-7(6)11-8/h1-5H
(5)Std. InChIKey: FVJQNINMQYFIEQ-UHFFFAOYSA-N