Benzonitrile, 4-amino-3-nitro-
3-Nitro-4-Aminobenzonitrile
CAS: 6393-40-4
Molecular Formula: C7H5N3O2
Benzonitrile, 4-amino-3-nitro- - Names and Identifiers
| Name | 3-Nitro-4-Aminobenzonitrile |
| Synonyms | 2-Nitro-4-cyanoaniline 4-Cyano-2-nitroaniline 4-Amino-3-nitrobenzonitrile 4-AMINO-3-NITROBENZONITRILE 3-Nitro-4-Aminobenzonitrile Benzonitrile, 4-amino-3-nitro- 4-Amino-3-nitrobenzolcarbonitril 4-Cyano-2-nitroaniline, 2-Amino-5-cyanonitrobenzene |
| CAS | 6393-40-4 |
| InChI | InChI=1/C7H5N3O2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2 |
| InChIKey | JAHADAZIDZMHOP-UHFFFAOYSA-N |
Benzonitrile, 4-amino-3-nitro- - Physico-chemical Properties
| Molecular Formula | C7H5N3O2 |
| Molar Mass | 163.13 |
| Density | 1.41±0.1 g/cm3(Predicted) |
| Melting Point | 159-162 °C (lit.) |
| Boling Point | 349.8±32.0 °C(Predicted) |
| Flash Point | 165.4°C |
| Solubility | Soluble in ethanol and benzene. |
| Vapor Presure | 4.58E-05mmHg at 25°C |
| Appearance | Powder, Crystals or Crystalline Powder |
| Color | Yellow |
| BRN | 778939 |
| pKa | -3.52±0.10(Predicted) |
| Storage Condition | Keep in dark place,Inert atmosphere,Room temperature |
| Refractive Index | 1.626 |
| MDL | MFCD00013373 |
Benzonitrile, 4-amino-3-nitro- - Risk and Safety
| Risk Codes | R36/37/38 - Irritating to eyes, respiratory system and skin. R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. |
| UN IDs | 3276 |
| WGK Germany | 3 |
| HS Code | 29269090 |
| Hazard Note | Irritant |
| Hazard Class | 6.1 |
| Packing Group | III |
Benzonitrile, 4-amino-3-nitro- - Introduction
The chemical formula is C7H5N3O2 and the molecular weight is 163.14g/mol. It is an organic compound containing amino and nitro functional groups.
Nature:
A pale yellow solid with a faint aroma. It can be dissolved in most organic solvents at room temperature, such as ethanol, dimethyl ketone and chloroform. Its solubility in water is low.
Use:
widely used in organic synthesis. It is a commonly used intermediate that can be used in the synthesis of different classes of drugs and dyes. In addition, it can also be used to prepare polymers and organic light-emitting materials.
Preparation Method:
It can be synthesized by a variety of methods, one of which is commonly used by the reaction of p-nitrobenzonitrile and aminophenylacetone. The reaction takes place under basic conditions and requires a suitable solvent and catalyst.
Safety Information:
Toxic gases may be produced when heated or in contact with strong oxidants. It is a potential carcinogen and should avoid inhalation and contact with skin. Before use should understand the relevant safety procedures, and maintain good personal protective measures, such as wearing gloves and protective glasses. At the same time, avoid contact with combustibles and oxidants, and properly store and handle the compound.
Nature:
A pale yellow solid with a faint aroma. It can be dissolved in most organic solvents at room temperature, such as ethanol, dimethyl ketone and chloroform. Its solubility in water is low.
Use:
widely used in organic synthesis. It is a commonly used intermediate that can be used in the synthesis of different classes of drugs and dyes. In addition, it can also be used to prepare polymers and organic light-emitting materials.
Preparation Method:
It can be synthesized by a variety of methods, one of which is commonly used by the reaction of p-nitrobenzonitrile and aminophenylacetone. The reaction takes place under basic conditions and requires a suitable solvent and catalyst.
Safety Information:
Toxic gases may be produced when heated or in contact with strong oxidants. It is a potential carcinogen and should avoid inhalation and contact with skin. Before use should understand the relevant safety procedures, and maintain good personal protective measures, such as wearing gloves and protective glasses. At the same time, avoid contact with combustibles and oxidants, and properly store and handle the compound.
Last Update：2024-04-09 21:11:58
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View History
Benzonitrile, 4-amino-3-nitro-
881456-40-2
(S)-N4-(3-chloro-4-fluorophenyl)-7-(tetrahydrofuran-3-yloxy)quinazoline-4,6-diammine
1H-Purine-2,6-dione, 8-[bis(2-chloroethyl)amino]-3,7-dihydro-1,3,7-trimethyl-
87915-38-6
2-Butenylene diacetate
[S-(R,S)]-Phenylmethyl [1-oxiranyl-2-(phenylthio)ethyl]carbamate
3-Furanmethanol, α-ethenyltetrahydro-
2-chloro-N-(4-methyl-1,3-thiazol-2-yl)propanamide
Methyl 4-acetyl-3-hydroxybenzoate
881456-40-2
(S)-N4-(3-chloro-4-fluorophenyl)-7-(tetrahydrofuran-3-yloxy)quinazoline-4,6-diammine
1H-Purine-2,6-dione, 8-[bis(2-chloroethyl)amino]-3,7-dihydro-1,3,7-trimethyl-
87915-38-6
2-Butenylene diacetate
[S-(R,S)]-Phenylmethyl [1-oxiranyl-2-(phenylthio)ethyl]carbamate
3-Furanmethanol, α-ethenyltetrahydro-
2-chloro-N-(4-methyl-1,3-thiazol-2-yl)propanamide
Methyl 4-acetyl-3-hydroxybenzoate