3-Chloro-4-nitrotoluene

Product Name: 3-Chloro-4-nitrotoluene
CAS No.: 38939-88-7
Chemical Name: 3-Chloro-4-nitrotoluene
Synonyms: 3-Chloro-4-nitrotolu;3-chloro-4-Nitrotoluol;3-CHLORO-4-NITROTOLUENE;3-Chloro-4-Nitrotoluene98%;3-CHLORO-4-NITROTOLUENE 98%;3-Chloro-4-nitrotoluene >5-Methyl-2-nitrochlorobenzene;3-Chloro-4-nitrotoluene, 98% 5GR;1-Nitro-2-chloro-4-methylbenzene;1-Chloro-2-nitro-5-methylbenzene
CBNumber: CB5204162
Molecular Formula: C7H6ClNO2
Formula Weight: 171.58
MOL File: 38939-88-7.mol

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3-Chloro-4-nitrotoluene Property

Melting point:: 24-28 °C (lit.)
Boiling point:: 219 °C (lit.)
Density: 1.3246 (rough estimate)
refractive index: n20/D 1.564(lit.)
Flash point:: >230 °F
storage temp.: Sealed in dry,Room Temperature
form: Liquid After Melting
color: Clear yellow
InChI: InChI=1S/C7H6ClNO2/c1-5-2-3-7(9(10)11)6(8)4-5/h2-4H,1H3
InChIKey: KGSQRFPDZCBVBS-UHFFFAOYSA-N
SMILES: C1([N+]([O-])=O)=CC=C(C)C=C1Cl
CAS DataBase Reference: 38939-88-7(CAS DataBase Reference)
NIST Chemistry Reference: Benzene, 2-chloro-4-methyl-1-nitro-(38939-88-7)

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Safety

Hazard Codes: Xn,Xi,N
Risk Statements: 22-36/37/38-20/21/22-52/53
Safety Statements: 36/37/39-26-61-24/25
RIDADR: UN 3457 6.1/PG 3
WGK Germany: 3
Hazard Note: Irritant
HazardClass: 6.1
PackingGroup: III
HS Code: 29049090

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H302Harmful if swallowed

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

Sigma-Aldrich

Product number: 643963
Product name: 3-Chloro-4-nitrotoluene
Purity: 97%
Packaging: 25g
Price: $75.63
Updated: 2025/07/31

TCI Chemical

Product number: C2277
Product name: 3-Chloro-4-nitrotoluene
Purity: >98.0%(GC)
Packaging: 5g
Price: $26
Updated: 2025/07/31

TCI Chemical

Product number: C2277
Product name: 3-Chloro-4-nitrotoluene
Purity: >98.0%(GC)
Packaging: 25g
Price: $76
Updated: 2025/07/31

TRC

Product number: C374815
Product name: 3-Chloro-4-nitrotoluene
Packaging: 250mg
Price: $45
Updated: 2021/12/16

Matrix Scientific

Product number: 075898
Product name: 2-Chloro-4-methyl-1-nitrobenzene
Purity: 95+%
Packaging: 5g
Price: $59
Updated: 2021/12/16

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3-Chloro-4-nitrotoluene Chemical Properties,Usage,Production

Chemical Properties

clear yellow liquid after melting

Uses

3-Chloro-4-nitrotoluene is used in the synthesis of quinoxaline derivatives in the development of a positron emission tomography radiotracer for the imaging of N-Methyl-D-aspartate receptor (NMDAR).

Synthesis

3113-72-2

38939-88-7

To a Silak reaction tube equipped with a magnetic stirrer were sequentially added 6.2 mg of silver sulfate (Ag2SO4), 36.3 mg of copper acetate (Cu(OAc)2), 12.5 mg of 2,9-dimethyl-1,10-o-phenanthroline (as a ligand), 36.2 mg of 5-methyl-2-nitrobenzoic acid (as a substrate) and 17.5 mg of sodium chloride (NaCl) in 4 mL of dimethyl sulfoxide (DMSO). The reaction mixture was heated and stirred in an oil bath at 160 °C for 24 h under oxygen (O2) atmosphere. Upon completion of the reaction, the reaction was quenched by the addition of an appropriate amount of distilled water, followed by three extractions with ethyl acetate (10 mL each). The organic phases were combined, dried over anhydrous sodium sulfate and concentrated under reduced pressure to give 14.8 mg of 3-chloro-4-nitrotoluene (target product) in 43% yield.

References

[1] Patent: CN107325002, 2017, A. Location in patent: Paragraph 0118
[2] Journal of Organic Chemistry, 2016, vol. 81, # 7, p. 2794 - 2803

3-Chloro-4-nitrotoluene Preparation Products And Raw materials

Raw materials

Preparation Products

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3-Chloro-4-nitrotoluene Suppliers

Americas 1 Belgium 2 Canada 1 China 180 Europe 3 France 1 Germany 3 India 7 Japan 5 Switzerland 3 United Kingdom 16 United States 36 Global 258

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View Lastest Price from 3-Chloro-4-nitrotoluene manufacturers

Shaanxi Dideu New Materials Co. Ltd

Product: 3-Chloro-4-nitrotoluene 38939-88-7
Price: US $0.00-0.00/KG
Min. Order: 1KG
Purity: 98.0%
Supply Ability: 10000KGS
Release date: 2025-07-04

Henan Fengda Chemical Co., Ltd

Product: 3-Chloro-4-nitrotoluene 38939-88-7
Price: US $100.00-1.00/KG
Min. Order: 1KG
Purity: 99%
Supply Ability: g-kg-tons, free sample is available
Release date: 2023-12-26

Career Henan Chemical Co

Product: 3-Chloro-4-nitrotoluene 38939-88-7
Price: US $1.00/KG
Min. Order: 1KG
Purity: 99%
Supply Ability: 100kg
Release date: 2019-07-12

38939-88-7, 3-Chloro-4-nitrotolueneRelated Search:

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38939-88-7

Organic Building Blocks

Halogenated Hydrocarbons

Building Blocks

C7

Aryl

Halogen toluene

Aryl

C7

Halogenated Hydrocarbons

blocks

NitroCompounds

Aromatic Hydrocarbons (substituted) & Derivatives