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7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE

1-(7,8-dinitro-1,2,4,5-tetrahydro-1,5-methano-3H-3-benzazepin-3-yl)-2,2,2-trifluoroethanone

CAS: 230615-59-5

Molecular Formula: C13H10F3N3O5

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  5. 7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE

7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE - Names and Identifiers

Name 1-(7,8-dinitro-1,2,4,5-tetrahydro-1,5-methano-3H-3-benzazepin-3-yl)-2,2,2-trifluoroethanone
Synonyms 8-dinitro-1
5-tetrahydro-7
7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE
2,3,4,5-Tetrahydro-7,8-dinitro-3-(trifluoroacetyl)-1,5-methano-1H-3-benzazepine
1-(4,5-Dinitro-10-azatricyclo[6.3.1.0]dodeca-2,4,6-trien-10-yl)-2,2,2-trifluoroethanone
1-(4,5-DINITRO-10-AZA-TRICYCLO[6.3.1.0]DODECA-2,4,6-TRIEN-10-YL)-2,2,2-TRIFLUORO-ETHANONE
1-(7,8-Dinitro-4,5-dihydro-1H-1,5-methanobenzo-[d]azepin-3(2H)-yl)-2,2,2-trifluoroethanone
1-(7,8-dinitro-1,2,4,5-tetrahydro-1,5-methano-3H-3-benzazepin-3-yl)-2,2,2-trifluoroethanone
1-(7,8-dinitro-1,2,4,5-tetrahydro-3H-1,5-methano-3-benzazepin-3-yl)-2,2,2-trifluoroethanonato
Ethanone, 2,2,2-trifluoro-1-(1,2,4,5-tetrahydro-7,8-dinitro-1,5-methano-3H-3-benzazepin-3-yl)-
1-(4,5-dinitro-10-aza-tricyclo[6.3.1.02,7]dodeca-2(7),3,5-trien-10-yl)-2,2,2-trifluoro-ethanone
1-(4,5-Dinitro-10-aza-tricyclo[6.3.1.0]dodeca-2,4,6-trien-10-yl)-2,2,2-trifluoro-ethanone, Varenicline Intermediate
CAS 230615-59-5
InChI InChI=1/C13H10F3N3O5/c14-13(15,16)12(20)17-4-6-1-7(5-17)9-3-11(19(23)24)10(18(21)22)2-8(6)9/h2-3,6-7H,1,4-5H2

7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE - Physico-chemical Properties

Molecular FormulaC13H10F3N3O5
Molar Mass345.23
Density1.604
Melting Point175-177°C
Boling Point520.4±50.0 °C(Predicted)
Flash Point268.533°C
Solubility Chloroform (Slightly), Methanol (Slightly)
Vapor Presure0mmHg at 25°C
AppearanceSolid
ColorWhite to Light Yellow
pKa-1.93±0.20(Predicted)
Storage Condition2-8°C
Refractive Index1.584

7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE - Introduction

1-(7,8-dinitro-1,2,4,5-tetrahydro-1, phenyl)-2,2, 2-trifluororoethanone (1-(7,8-dinitro-1,2,4,5-tetrahydro-1, phenyl)-2,2,2-trifluoroethanone) is an organic compound with the following properties:

1. Appearance: common colorless to light yellow solid.
2. Solubility: can be dissolved in organic solvents such as ethanol, ether and dichloromethane, insoluble in water.
3. Melting Point: the melting point is higher, about 160-165 ℃.
4. Stability: The compound is relatively unstable to air and light, and should be stored in a dry, cool, and dark place.

This compound is similar to a restricted Amine, which can be used in the synthesis of other compounds or as a pharmaceutical intermediate. Specific uses include:

1. Drug research: It is an important organic synthesis intermediate that can be used to synthesize biologically active molecules, such as drugs and pesticides.
2. Explosive field: Due to the existence of its nitro group and ring structure, it also has applications in the field of explosives and can be used to prepare explosives or propellants.

The preparation method is more complex, generally involving multi-step reaction and intermediate synthesis. The specific steps involve organic synthesis techniques and reagents, which are not suitable for at-home preparation for general chemical enthusiasts or non-professionals.

Regarding the safety information of this compound, due to its nitro group and possible toxicity, caution should be exercised in handling and use:

1. Toxicity: may be potentially toxic to the human body, may be irritating to the skin, eyes and respiratory tract.
2. Storage: should be stored in a container that meets the chemical storage requirements, and away from fire and flammable materials.
3. Operation: in the operation, should take appropriate safety measures, such as wearing chemical protective gloves and goggles, and ensure good ventilation.

For information on the specific safe handling and use of this compound, it is recommended to follow relevant safety guidelines and regulations in the laboratory or in a suitable professional environment, and to consult a professional for advice.
Last Update:2024-04-09 21:54:55
7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE
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View History
7,8-DINITRO-3-(TRIFLUOROACETYL)-2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE
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