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Benzenamine,2,3-dinitro-

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Name

Benzenamine,2,3-dinitro-

EINECS N/A
CAS No. 602-03-9 Density 1.586 g/cm3
PSA 117.66000 LogP 2.71280
Solubility N/A Melting Point 128°C
Formula C6H5N3O4 Boiling Point 423.9 °C at 760 mmHg
Molecular Weight 183.123 Flash Point 210.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 602-03-9 (2,3-DINITROANILINE) Hazard Symbols N/A
Synonyms

Aniline,2,3-dinitro- (7CI,8CI);2,3-Dinitroaniline;NSC 37400;

 

Benzenamine,2,3-dinitro- Specification

The Benzenamine,2,3-dinitro- is an organic compound with the formula C6H5N3O4. The IUPAC name of this chemical is 2,3-dinitroaniline. With the CAS registry number 602-03-9, it is also named as 2,3-Dinitrobenzenamine.

Physical properties about Benzenamine,2,3-dinitro- are: (1)ACD/LogP: 2.42; (2)ACD/LogD (pH 5.5): 2.42; (3)ACD/LogD (pH 7.4): 2.42; (4)ACD/BCF (pH 5.5): 40.79; (5)ACD/BCF (pH 7.4): 40.79; (6)ACD/KOC (pH 5.5): 494.83; (7)ACD/KOC (pH 7.4): 494.83; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 94.88 Å2; (12)Index of Refraction: 1.679; (13)Molar Refractivity: 43.58 cm3; (14)Molar Volume: 115.3 cm3; (15)Polarizability: 17.27×10-24cm3; (16)Surface Tension: 79 dyne/cm; (17)Density: 1.586 g/cm3; (18)Flash Point: 210.2 °C; (19)Enthalpy of Vaporization: 67.83 kJ/mol; (20)Boiling Point: 423.9 °C at 760 mmHg; (21)Vapour Pressure: 2.16E-07 mmHg at 25°C.

Preparation of Benzenamine,2,3-dinitro-: this chemical can be prepared by N-(3-nitro-phenyl)-acetamide. This reaction will need reagent conc. sulfuric acid. The reaction time is 3 hours at ambient temperature. The yield is about 32%.

Benzenamine,2,3-dinitro- can be prepared by N-(3-nitro-phenyl)-acetamide

Uses of Benzenamine,2,3-dinitro-: it can be used to produce 1-chloro-2,3-dinitro-benzene at temperature of 60 °C. It will need reagent nitrosylfuric acid with reaction time of 10 min. The yield is about 60%.

Benzenamine,2,3-dinitro- can be used to produce 1-chloro-2,3-dinitro-benzene

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1c(cccc1N)[N+]([O-])=O
(2)InChI: InChI=1/C6H5N3O4/c7-4-2-1-3-5(8(10)11)6(4)9(12)13/h1-3H,7H2
(3)InChIKey: CGNBQYFXGQHUQP-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C6H5N3O4/c7-4-2-1-3-5(8(10)11)6(4)9(12)13/h1-3H,7H2
(5)Std. InChIKey: CGNBQYFXGQHUQP-UHFFFAOYSA-N

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