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4-Amino-3-nitropyridine

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Name

4-Amino-3-nitropyridine

EINECS -0
CAS No. 1681-37-4 Density 1.437 g/cm3
PSA 84.73000 LogP 1.67640
Solubility Insoluble in water. Melting Point 203-207 °C(lit.)
Formula C5H5N3O2 Boiling Point 350.4 °C at 760 mmHg
Molecular Weight 139.114 Flash Point 165.7 °C
Transport Information N/A Appearance yellow crystalline powder
Safety 26-36-36/37/39 Risk Codes 22-36/37/38-20/21/22
Molecular Structure Molecular Structure of 1681-37-4 (4-Amino-3-nitropyridine) Hazard Symbols HarmfulXn
Synonyms

Pyridine,4-amino-3-nitro- (6CI,7CI,8CI);3-Nitro-4-aminopyridine;3-Nitro-4-pyridinamine;

Article Data 4

4-Amino-3-nitropyridine Specification

This chemical is called 4-Amino-3-nitropyridine, and its IUPAC name is 3-nitropyridin-4-amine. With the molecular formula of C5H5N3O2, its molecular weight is 139.11. The CAS registry number of this chemical is 1681-37-4. Additionally, its product categories are Pyridine; Pyridines derivates; Pyridines; Boronic Acid; C5; Heterocyclic Building Blocks.

Other characteristics of the 4-Amino-3-nitropyridine can be summarised as followings: (1)ACD/LogP: 1.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.14; (4)ACD/LogD (pH 7.4): 1.26; (5)ACD/BCF (pH 5.5): 4.04; (6)ACD/BCF (pH 7.4): 5.34; (7)ACD/KOC (pH 5.5): 87.31; (8)ACD/KOC (pH 7.4): 115.36; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 61.95 Å2; (13)Index of Refraction: 1.645; (14)Molar Refractivity: 35.12 cm3; (15)Molar Volume: 96.7 cm3; (16)Polarizability: 13.92×10-24cm3; (17)Surface Tension: 72.8 dyne/cm; (18)Density: 1.437 g/cm3; (19)Flash Point: 165.7 °C; (20)Enthalpy of Vaporization: 59.5 kJ/mol; (21)Boiling Point: 350.4 °C at 760 mmHg; (22)Vapour Pressure: 4.4E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating / harmful to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: O=[N+]([O-])c1c(N)ccnc1
2.InChI: InChI=1/C5H5N3O2/c6-4-1-2-7-3-5(4)8(9)10/h1-3H,(H2,6,7)
3.InChIKey: IUPPEELMBOPLDJ-UHFFFAOYAL

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