4-Nitro(~2~H_4_)phenol

Basic Information

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CAS Number

93951-79-2

Molecular Formula

C6HD4NO3

Molecular Weight

143.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

113-115 °C

Boiling Point

279 °C

SMILES

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

InChI

InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H/i1D,2D,3D,4D

InChIKey

BTJIUGUIPKRLHP-RHQRLBAQSA-N

LogP

1.82360

Complexity

123

Safety Information

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Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H332 Harmful if inhaled
Acute toxicity, inhalation

Synonyms & References

English

SCHEMBL12741899
4-Nitrophenol-2,3,5,6-d4, 98 atom % D, 98% (CP)
D99203
4-nitro(?H?)phenol
4-Nitrophenol D4
4-nitrophenol-d4
4-NITROPHENOL-RING-D4-D
4-Nitrophenol-2,3,5,6-d4
AKOS015916549
2,3,5,6-tetradeuterio-4-nitrophenol
Phen-2,3,5,6-d4-ol, 4-nitro-
4-Nitrophenol-2,3,5,6-d4, analytical standard
93951-79-2
4-Nitrophenol D4 100 microg/mL in Acetone
Phen-2,3,5,6-d4-ol,4-nitro-
4-Nitrophenol(d4)
4-NITROPHENOL-[2,3,5,6-D4]
4-Nitrophenol-2,3,5,6-d41000µg

MDL Number

MFCD00143352

FAQ

What are the physical and chemical properties of 4-Nitro(~2~H_4_)phenol (CAS: 93951-79-2)?

4-Nitro(~2~H_4_)phenol, also known as 2-hydroxynitrobenzene, is a crystalline white to pale yellow solid with a molecular weight of approximately 149.05 g/mol. It is slightly soluble in water and soluble in organic solvents. It is a reactive compound due to the presence of the nitro and hydroxyl groups. The compound exhibits acidity and can undergo electrophilic substitution reactions.

How is 4-Nitro(~2~H_4_)phenol (CAS: 93951-79-2) typically synthesized?

4-Nitro(~2~H_4_)phenol can be synthesized through the nitration of phenol. This process involves the reaction of phenol with nitric acid in the presence of sulfuric acid as a catalyst. The nitration occurs at the para position, and the yield can be improved by controlling the reaction conditions such as temperature and concentration.

What industries use 4-Nitro(~2~H_4_)phenol (CAS: 93951-79-2)?

4-Nitro(~2~H_4_)phenol is used in various industries, including pharmaceuticals, where it serves as a precursor for the synthesis of certain drugs. It is also utilized in the production of dyes, pigments, and as a component in some organic sensors and electronic devices due to its electronic properties.

What precautions should be taken when handling 4-Nitro(~2~H_4_)phenol (CAS: 93951-79-2)?

When handling 4-Nitro(~2~H_4_)phenol, appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat should be worn. The compound should be handled in a well-ventilated area or fume hood due to its reactive nature. Spills should be cleaned up carefully, and the site should be flushed with water. Safety data sheets (SDS) should be consulted for detailed handling and emergency procedures.