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5-METHYL-2-NITROBENZONITRILE

CAS No.
64113-86-6
Chemical Name:
5-METHYL-2-NITROBENZONITRILE
Synonyms
6-nitro-m-tolunitrile;Benzonitrile,5-Methyl-2-nitro-;5-METHYL-2-NITROBENZONITRILE ISO 9001:2015 REACH;Cyclohepta[c]pyrazole-3-carboxylicacid,2,4,5,6,7,11-hexahydro-,ethylester
CBNumber:
CB61484878
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.15
MDL Number:
MFCD00267507
MOL File:
64113-86-6.mol
MSDS File:
SDS
Last updated:2025-07-24 18:13:54

5-METHYL-2-NITROBENZONITRILE Properties

Melting point 92 °C
Boiling point 338.9±30.0 °C(Predicted)
Density 1.26±0.1 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
Appearance Off-white to yellow Solid

SAFETY

Risk and Safety Statements

HS Code  2926907090

5-METHYL-2-NITROBENZONITRILE price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
TRC M341270 5-Methyl-2-nitrobenzonitrile 64113-86-6 250mg $45 2021-12-16 Buy
American Custom Chemicals Corporation CHM0101468 5-METHYL-2-NITROBENZONITRILE 95.00% 64113-86-6 1G $187.95 2021-12-16 Buy
SynQuest Laboratories 4754-1-0D 5-Methyl-2-nitrobenzonitrile 95.0% 64113-86-6 5G $109 2021-12-16 Buy
Matrix Scientific 074354 5-Methyl-2-nitrobenzonitrile 95+% 64113-86-6 1g $347 2021-12-16 Buy
AK Scientific W7590 5-Methyl-2-nitrobenzonitrile 64113-86-6 25g $391 2021-12-16 Buy
Product number Packaging Price Buy
M341270 250mg $45 Buy
CHM0101468 1G $187.95 Buy
4754-1-0D 5G $109 Buy
074354 1g $347 Buy
W7590 25g $391 Buy

5-METHYL-2-NITROBENZONITRILE Chemical Properties,Uses,Production

Synthesis

5-METHYL-2-NITROBENZAMIDE

4315-12-2

5-METHYL-2-NITROBENZONITRILE

64113-86-6

Phosphorus trichloride (16.96 mL, 1.1 eq.) was slowly added to a solution of N,N-dimethylformamide (329.6 mL) of 5-methyl-2-nitrobenzamide (29.8 g, 0.165 mol) via syringe over a period of 20 minutes. The reaction mixture was stirred at 25 °C for 40 min, followed by heating to 100 °C and continued stirring for 15 min. Upon completion of the reaction, the mixture was slowly poured into ice (750 g) and the pH of the aqueous solution was adjusted to 9-10 with ammonia (75 mL).The aqueous layer was extracted with ethyl acetate (1000 mL, followed by 2 x 600 mL). The organic layers were combined, dried over anhydrous sodium sulfate, and concentrated under reduced pressure to afford 2-nitro-5-methylbenzonitrile (25.7 g, 96% yield) as a yellow solid, which could be used in subsequent reactions without further purification. The purity of the product was confirmed by 1H NMR: 1H NMR (CDCl3) δ 2.54 (s, 3H, CH3), 7.59 (d, J = 8.4 Hz, 1H, Ar-H), 7.71 (s, 1H, Ar-H), 8.24 (d, J = 8.4 Hz, 1H, Ar-H).

References

[1] Patent: US2004/92739, 2004, A1. Location in patent: Page 4
[2] Patent: US2009/253719, 2009, A1. Location in patent: Page/Page column 19-20
[3] Tetrahedron, 1994, vol. 50, # 18, p. 5515 - 5525
[4] Medicinal Chemistry Research, 1999, vol. 9, # 3, p. 176 - 185
[5] Patent: US2010/260825, 2010, A1. Location in patent: Page/Page column 4

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View Lastest Price from 5-METHYL-2-NITROBENZONITRILE manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
6-nitro-m-tolunitrile pictures 2025-09-25 6-nitro-m-tolunitrile
64113-86-6
US $5.00-0.50 / KG 1KG 99% g-kg-tons, free sample is available Henan Fengda Chemical Co., Ltd

5-METHYL-2-NITROBENZONITRILE Spectrum

Benzonitrile,5-Methyl-2-nitro- 5-METHYL-2-NITROBENZONITRILE ISO 9001:2015 REACH Cyclohepta[c]pyrazole-3-carboxylicacid,2,4,5,6,7,11-hexahydro-,ethylester 6-nitro-m-tolunitrile 64113-86-6 Aromatic Nitriles