5-Nitro-1H-indole

Basic Information

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CAS Number

6146-52-7

Molecular Formula

C8H6N2O2

Molecular Weight

162.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

140.0 to 144.0 deg-C

Boiling Point

362.6°C at 760 mmHg

Density

1.3264 (rough estimate)

Flash Point

173.1℃

Refractive Index

1.5770 (estimate)

SMILES

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C1=CC2=C(C=CN2)C=C1[N+](=O)[O-]

InChI

InChI=1S/C8H6N2O2/c11-10(12)7-1-2-8-6(5-7)3-4-9-8/h1-5,9H

InChIKey

OZFPSOBLQZPIAV-UHFFFAOYSA-N

LogP

2.59930

Complexity

190

Safety Information

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GHS Hazard Pictograms

H302

H318

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H318 Causes serious eye damage
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Class IRRITANT-HARMFUL Class IRRITANT-HARMFUL

Synonyms & References

English

4-CYANO-4-PHENYLPIPERIDINEHYDROCHLORIDE
NSC-520594
EINECS 228-153-0
NSC 520594
SMR002048627
EN300-39249
5-Nitroindole, 98%
1H-Indole, 5-nitro-
STR04237
F8889-7938
NITROINDOLE, 5-
Q27285232
MFCD00005673
N0400
A8522
CS-D1052
Z382696860
NSC520594
CCRIS 3255
UNII-O2BHX6EDBN
AKOS005199981
DTXSID80210403
CHEMBL164651
AC-7395
AM81195
HY-59273
BCP00104
SCHEMBL28686
AB00487
SCHEMBL17347355
Oprea1_492280

MDL Number

MFCD00005673

Customs Code

2933990090

FAQ

What is 5-Nitro-1H-indole (CAS: 6146-52-7)?

5-Nitro-1H-indole (CAS: 6146-52-7) is a heterocyclic aromatic compound belonging to the indole family. It has the chemical formula C8H7N2O2 and is characterized by a benzene ring fused to a pyrrole ring with a nitro group (-NO2) attached to the 5th carbon. It is commonly used as an intermediate in organic synthesis and has applications in medicinal chemistry due to its potential biological activities.

What are the main uses of 5-Nitro-1H-indole (CAS: 6146-52-7)?

5-Nitro-1H-indole (CAS: 6146-52-7) is primarily used in pharmaceutical research as a building block for synthesizing various bioactive compounds. It also finds applications in the production of dyes, pesticides, and other industrial chemicals. Its unique chemical structure makes it valuable in the development of drugs targeting specific biological pathways and in organic synthesis processes.

Is 5-Nitro-1H-indole (CAS: 6146-52-7) safe?

5-Nitro-1H-indole (CAS: 6146-52-7) is considered hazardous and requires careful handling. It may cause irritation to the skin, eyes, and respiratory system. Safety standards recommend using appropriate personal protective equipment (PPE) and working in well-ventilated areas. As with many organic compounds, it should be handled according to standard chemical safety protocols to minimize risks.

How should 5-Nitro-1H-indole (CAS: 6146-52-7) be stored?

5-Nitro-1H-indole (CAS: 6146-52-7) should be stored in a cool, dry, and dark place, away from moisture and light. It is best kept in a sealed container at a temperature below 25°C. Avoid exposure to air and store in a well-ventilated area to ensure stability and safety during handling and storage.