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Acetamide,N-(2-methyl-4-nitrophenyl)-

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Name

Acetamide,N-(2-methyl-4-nitrophenyl)-

EINECS N/A
CAS No. 2719-15-5 Density 1.289 g/cm3
PSA 74.92000 LogP 2.45780
Solubility N/A Melting Point 198-200°C
Formula C9H10N2O3 Boiling Point 393.3 °C at 760 mmHg
Molecular Weight 194.19 Flash Point 191.7 °C
Transport Information N/A Appearance off-white solid
Safety 26-36/37/39 Risk Codes 36/37/38 20/21/22
Molecular Structure Molecular Structure of 2719-15-5 (Acetamide,N-(2-methyl-4-nitrophenyl)-) Hazard Symbols IrritantXi
Synonyms

o-Acetotoluidide,4'-nitro- (6CI,7CI,8CI);2'-Methyl-4'-nitroacetanilide;5-Nitro-2-acetamidotoluene;Acetyl-p-nitro-o-toluidine;NSC 29042;

Article Data 15

Acetamide,N-(2-methyl-4-nitrophenyl)- Specification

The Acetamide,N-(2-methyl-4-nitrophenyl)- with CAS registry number of 2719-15-5 is also called 2'-Methyl-4'-nitroacetanilide and 5-Nitro-2-acetamidotoluene. In addition, the formula is C9H10N2O3 and the molecular weight is 194.1873. It has irritant. 

Physical properties about this chemical are: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.12; (4)ACD/LogD (pH 7.4): 2.12; (5)ACD/BCF (pH 5.5): 24.06; (6)ACD/BCF (pH 7.4): 24.06; (7)ACD/KOC (pH 5.5): 339.1; (8)ACD/KOC (pH 7.4): 339.1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 66.13 Å2; (13)Index of Refraction: 1.605; (14)Molar Refractivity: 51.89 cm3; (15)Molar Volume: 150.6 cm3; (16)Polarizability: 20.57 ×10-24cm3; (17)Surface Tension: 51.8 dyne/cm; (18)Density: 1.289 g/cm3; (19)Flash Point: 191.7 °C; (20)Enthalpy of Vaporization: 64.32 kJ/mol; (21)Boiling Point: 393.3 °C at 760 mmHg; (22)Vapour Pressure: 2.15E-06 mmHg at 25°C.

Preparation of Acetamide,N-(2-methyl-4-nitrophenyl)-: It can be prepared by acetic acid anhydride and 2-methyl-aniline. The other product is acetic acid-(2-methyl-6-nitro-anilide). This reaction needs reagent HNO3. The yield is 60%.

Acetamide,N-(2-methyl-4-nitrophenyl)- can be prepared by acetic acid anhydride and 2-methyl-aniline. The other product is acetic acid-(2-methyl-6-nitro-anilide).

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. When you are using it, wear suitable gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(cc1C)[N+]([O-])=O)C
(2)InChI: InChI=1/C9H10N2O3/c1-6-5-8(11(13)14)3-4-9(6)10-7(2)12/h3-5H,1-2H3,(H,10,12)
(3)InChIKey: JZEOVPGWIWSSAK-UHFFFAOYAV

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