1-(4-Nitrophenyl)ethanone

Basic Information

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CAS Number

100-19-6

Molecular Formula

C8H7NO3

Molecular Weight

165.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

76.0 to 80.0 deg-C

Boiling Point

167°C/5mmHg

Water Solubility

Insoluble in water.

Flash Point

201-202℃

Refractive Index

1.5468 (estimate)

SMILES

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CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3

InChIKey

YQYGPGKTNQNXMH-UHFFFAOYSA-N

LogP

2.32060

Complexity

189

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

MFCD00007355
FT-0689209
p-Nitro-acetophenone
1-(4-Nitro-phenyl)-ethanone
1-(4-Nitrophenyl)ethanone #
NSC-41590
4-(nitrophenyl)carbonyl
4-Acetylnitrobenzene
4FM2J8HQ27
CHEMBL167997
NSC41590
C02803
PS-4614
100-19-6
NSC 41590; p-Acetylnitrobenzene
DTXSID1025724
1-(4-Nitrophenyl)ethanone
CHEBI:28735
DTXCID105724
p-Nitroacetophenone
ACETOPHENONE, P-NITRO-
1-(4-nitro-phenyl)ethanone
SCHEMBL27765
Q27103872
p-nitro acetophenone
A936889
p-Acetylnitrobenzene
F0001-0011
NSC 41590
CAS-100-19-6
SMR001224529

MDL Number

MFCD00007355

Customs Code

29147090

FAQ

What is 1-(4-Nitrophenyl)ethanone (CAS: 100-19-6)?

1-(4-Nitrophenyl)ethanone, with CAS number 100-19-6, is an organic compound classified as an aromatic ketone. Its chemical formula is C8H8NO4, and it appears as a yellow solid. It is insoluble in water but soluble in organic solvents like ethanol. The molecule contains a nitro group (-NO2) attached to a phenyl ring, making it reactive and prone to oxidation. It is commonly used as an intermediate in chemical synthesis.

What are the main uses of 1-(4-Nitrophenyl)ethanone (CAS: 100-19-6)?

1-(4-Nitrophenyl)ethanone (CAS: 100-19-6) is primarily utilized in pharmaceuticals as an intermediate for synthesizing antifungal and anti-inflammatory drugs. In industrial applications, it serves as a precursor for dyes, pesticides, and other organic compounds. It is also employed in research for developing new materials and chemical processes. Its versatility stems from the functional groups available for further modification.

Is 1-(4-Nitrophenyl)ethanone (CAS: 100-19-6) safe?

1-(4-Nitrophenyl)ethanone (CAS: 100-19-6) requires careful handling due to its potential toxicity. Inhalation or skin contact may cause irritation, and it is classified as harmful. Safety standards emphasize the need for protective equipment like gloves and goggles. Always follow OSHA guidelines and ensure proper ventilation when working with this compound to minimize risks.

How should 1-(4-Nitrophenyl)ethanone (CAS: 100-19-6) be stored?

1-(4-Nitrophenyl)ethanone (CAS: 100-19-6) should be stored in a sealed, airtight container in a cool (below 25°C), dry, and dark place to maintain stability. It is sensitive to light and heat, so storage away from these conditions is crucial. Keep it in a well-ventilated area and avoid exposure to moisture or incompatible substances to prevent degradation.