3-Bromo-6-nitroquinoline

Basic Information

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CAS Number

7101-95-3

Molecular Formula

C9H5BrN2O2

Molecular Weight

253.05 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

170-171 ºC

Density

1.747±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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C1=CC2=NC=C(C=C2C=C1[N+](=O)[O-])Br

InChI

InChI=1S/C9H5BrN2O2/c10-7-3-6-4-8(12(13)14)1-2-9(6)11-5-7/h1-5H

InChIKey

XIGQUURJVUSYBF-UHFFFAOYSA-N

Complexity

231

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

MFCD12024480
A1-01823
SY105848
DTXSID10572187
3-bromo-6-nitroquinoline
AMY26101
A837050
7101-95-3
AKOS015919332
FT-0653953
DS-2894
3-bromanyl-6-nitro-quinoline
SB71710
SCHEMBL4816985
CS-0155647
3-Bromo-6-nitroquinoline
AK126283
6-Nitro-3-bromoquinoline
(R)-oct-7-yn-2-ol
9035AF
OR45087
FCH1328518
AB1010360
ST2410566
AX8239487
3-bromo-6-nitro-quinoline

MDL Number

MFCD12024480

FAQ

What are the physical and chemical properties of 3-Bromo-6-nitroquinoline (CAS: 7101-95-3)?

3-Bromo-6-nitroquinoline (CAS: 7101-95-3) is a crystalline solid with a molecular weight of approximately 241.02 g/mol. It is slightly soluble in water and more soluble in organic solvents like methanol and ethanol. Chemically, it is highly reactive due to the presence of a nitro group and a bromine atom. It can undergo various reactions such as reduction, substitution, and oxidation.

How is 3-Bromo-6-nitroquinoline (CAS: 7101-95-3) typically synthesized?

3-Bromo-6-nitroquinoline (CAS: 7101-95-3) can be synthesized via a multi-step process. Commonly, starting from 6-nitroquinoline, bromination is performed using N-bromosuccinimide (NBS) in the presence of a radical initiator like AIBN. The reaction typically yields a high yield with good selectivity towards the bromo substitution.

What industries use 3-Bromo-6-nitroquinoline (CAS: 7101-95-3)?

3-Bromo-6-nitroquinoline (CAS: 7101-95-3) is primarily used in the pharmaceutical industry for the synthesis of drug intermediates. It also finds applications in the polymer industry for certain polymer modifications and in the development of sensors and semiconductors due to its electronic properties.

What precautions should be taken when handling 3-Bromo-6-nitroquinoline (CAS: 7101-95-3)?

When handling 3-Bromo-6-nitroquinoline (CAS: 7101-95-3), it is crucial to use appropriate personal protective equipment (PPE) such as gloves and goggles. Work should be conducted in a fume hood to minimize exposure. Spills should be contained and cleaned up using appropriate absorbents, and the area should be ventilated. Always refer to the Safety Data Sheet (SDS) for detailed handling and safety information.