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2,5-Dichloro-3-nitro-4-picoline

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Name

2,5-Dichloro-3-nitro-4-picoline

EINECS N/A
CAS No. 89167-20-4 Density 2.348g/cm3
PSA 12.89000 LogP 2.44870
Solubility N/A Melting Point N/A
Formula C5H3BrIN Boiling Point 279.99 °C at 760 mmHg
Molecular Weight 283.894 Flash Point 123.134 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 89167-20-4 (4-Bromo-3-iodopyridine) Hazard Symbols N/A
Synonyms

pyridine, 4-bromo-3-iodo-;4-Bromo-3-iodopyridine;

 

2,5-Dichloro-3-nitro-4-picoline Specification

The 4-Bromo-3-iodopyridine with cas registry number of 89167-20-4, belongs to the following product categories: Pyridine. It has the systematic name of 4-bromo-3-iodo-pyridine. And it is also called pyridine, 4-bromo-3-iodo-.

Physical properties about this chemical are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.504; (4)ACD/LogD (pH 7.4): 2.504; (5)ACD/BCF (pH 5.5): 47.086; (6)ACD/BCF (pH 7.4): 47.109; (7)ACD/KOC (pH 5.5): 548.288; (8)ACD/KOC (pH 7.4): 548.553; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.666; (14)Molar Refractivity: 44.941 cm3; (15)Molar Volume: 120.915 cm3; (16)Polarizability: 17.816×10-24cm3; (17)Surface Tension: 53.836 dyne/cm; (18)Enthalpy of Vaporization: 49.786 kJ/mol; (19)Vapour Pressure: 0.007 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: c1cncc(c1Br)I
(2)InChI: InChI=1/C5H3BrIN/c6-4-1-2-8-3-5(4)7/h1-3H
(3)InChIKey: KDWZDHRURBJEIN-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C5H3BrIN/c6-4-1-2-8-3-5(4)7/h1-3H
(5)Std. InChIKey: KDWZDHRURBJEIN-UHFFFAOYSA-N

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