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2-METHYL-5-NITROBENZOTRIFLUORIDE

2-METHYL-5-NITROBENZOTRIFLUORIDE structure

CAS No.: 89976-12-5

Chemical Name:: 2-METHYL-5-NITROBENZOTRIFLUORIDE

Synonyms: PotinibImpurity6;-5-nitrobenzotrifL;Ponatinib Impurity 6;2-methyl-5-nitrotoluene;4-nitro-2-trifluorotoluen;4-nitro-2-trifluorotoluene;2-METHYL-5-NITROBENZOTRIFLUORIDE;Para-methyltrifluoromethylbenzene;4-NITRO-2-(TRIFLUOROMETHYL)TOLUENE;3-TrifluoroMethyl-4-Methylnitrobenzene

CBNumber:: CB4308218

Molecular Formula:: C8H6F3NO2

Molecular Weight:: 205.13

MDL Number:: MFCD01631684

MOL File:: 89976-12-5.mol

MSDS File:: SDS

Last updated:2025-07-24 18:13:52

Product description	Number	Pack Size	Price
2-Methyl-5-nitrobenzotrifluoride	M2798	1G	$20
2-Methyl-5-nitrobenzotrifluoride	M2798	5G	$69
2-Methyl-5-nitrobenzotrifluoride	M338955	50g	$470
2-(Trifluoromethyl)-4-nitrotoluene	J98477	100g	$288
2-Methyl-5-nitrobenzotrifluoride	PC0422	100g	$290
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2-METHYL-5-NITROBENZOTRIFLUORIDE Properties

Melting point	34-35 °C
Boiling point	220.5±35.0 °C(Predicted)
Density	1.357±0.06 g/cm3(Predicted)
storage temp.	under inert gas (nitrogen or Argon) at 2-8°C
form	Solid
color	Off-white
Water Solubility	Slightly soluble in water.
Sensitive	Moisture Sensitive
InChI	InChI=1S/C8H6F3NO2/c1-5-2-3-6(12(13)14)4-7(5)8(9,10)11/h2-4H,1H3
InChIKey	SVQCVQCIZWSPPX-UHFFFAOYSA-N
SMILES	C1(C)=CC=C([N+]([O-])=O)C=C1C(F)(F)F
CAS DataBase Reference	89976-12-5(CAS DataBase Reference)

SAFETY

Risk and Safety Statements

Symbol(GHS)

GHS07

Signal word

Danger

Hazard statements

H302-H312-H315-H319-H332-H335

Precautionary statements

P261-P280-P304+P340-P305+P351+P338-P405-P501a

Hazard Codes

Risk Statements

20/21/22-36/37/38

Safety Statements

23-26-36/37/39

Hazard Note

Harmful

HazardClass

IRRITANT-HARMFUL

HazardClass

6.1

HS Code

2904990090

NFPA 704

	1
2		0

2-METHYL-5-NITROBENZOTRIFLUORIDE price More Price(34)

Manufacturer	Product number	Product description	CAS number	Packaging	Price	Updated	Buy
TCI Chemical	M2798	2-Methyl-5-nitrobenzotrifluoride	89976-12-5	1G	$20	2025-07-31	Buy
TCI Chemical	M2798	2-Methyl-5-nitrobenzotrifluoride	89976-12-5	5G	$69	2025-07-31	Buy
TRC	M338955	2-Methyl-5-nitrobenzotrifluoride	89976-12-5	50g	$470	2021-12-16	Buy
AK Scientific	J98477	2-(Trifluoromethyl)-4-nitrotoluene	89976-12-5	100g	$288	2021-12-16	Buy
Apolloscientific	PC0422	2-Methyl-5-nitrobenzotrifluoride	89976-12-5	100g	$290	2021-12-16	Buy

Product number	Packaging	Price	Buy
M2798	1G	$20	Buy
M2798	5G	$69	Buy
M338955	50g	$470	Buy
J98477	100g	$288	Buy
PC0422	100g	$290	Buy

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

Chemical Properties

light yellow or crystalline

Uses

Employed as an important intermediate for raw material for organic synthesis, agrochemical, pharmaceutical and dyestuff field

Synthesis

13630-19-8

89976-12-5

General procedure for the synthesis of 2-methyl-5-nitrobenzotrifluoride from o-toluotrifluoride: 50 g of 2-trifluoromethyltoluene and 250 g of 98% sulfuric acid were added to a 250 mL four-necked flask with stirring and cooled to 10°C. The reaction was carried out over a period of time. 50 g of 65% nitric acid was added slowly and dropwise over a period of about 2 hours to ensure complete reaction. Upon completion of the reaction, the reaction solution was poured into 200 g of crushed ice and layered with 150 mL of dichloromethane. The aqueous phase was extracted once more with 100 mL of dichloromethane and the organic phases were combined. The organic phase was washed sequentially with 80 mL of saturated sodium bicarbonate solution and 50 mL of water. Concentration to dryness gave 62 g of a light yellow oily product in 97% yield. The product did not need further purification and could be used directly in the next reaction.

References

[1] Patent: CN106316864, 2017, A. Location in patent: Paragraph 0049; 0050; 0056; 0057; 0063; 0064

2-METHYL-5-NITROBENZOTRIFLUORIDE synthesis

Synthesis of 2-METHYL-5-NITROBENZOTRIFLUORIDE from 2-Methylbenzotrifluoride

2-METHYL-5-NITROBENZOTRIFLUORIDE Preparation Products And Raw materials

Raw materials

2-Bromo-4-nitrotoluene 2-Methylbenzotrifluoride Sodium trifluoroacetate

Preparation Products

4-Methyl-3-(trifluoromethyl)aniline

2-METHYL-5-NITROBENZOTRIFLUORIDE Suppliers

Global( 236)Suppliers

Supplier	Tel	Email	Country	ProdList	Advantage
Changzhou Fullone Chemical Co., Ltd.	+86-13328197671 +86-13861172460	sales@borenchem.cn	China	1055	58
Jinan Zhonghan Chemical Technology Co., LTD.	+undefined15066662237	3281004549@qq.com	China	291	58
Capot Chemical Co.,Ltd.	+86-（0）57185586718; +8613336195806	sales@capot.com	China	29734	60
Fluoropharm Co., Ltd.	+86-0571-85586753 +86-13336034509	sales@fluoropharm.com	China	1445	60
ATK CHEMICAL COMPANY LIMITED	+undefined-21-51877795	ivan@atkchemical.com	China	33024	60
career henan chemical co	+86-0371-86658258 +8613203830695	sales@coreychem.com	China	29852	58
Nanjing Dolon Biotechnology Co.,Ltd.	18905173768	52513593@qq.com	CHINA	2972	58
Hubei xin bonus chemical co. LTD	86-13657291602	linda@hubeijusheng.com	CHINA	22963	58
Standardpharm Co. Ltd.	86-714-3992388	overseasales1@yongstandards.com	United States	14332	58
Alchem Pharmtech,Inc.	8485655694	sales@alchempharmtech.com	United States	63687	58

Supplier	Advantage
Changzhou Fullone Chemical Co., Ltd.	58
Jinan Zhonghan Chemical Technology Co., LTD.	58
Capot Chemical Co.,Ltd.	60
Fluoropharm Co., Ltd.	60
ATK CHEMICAL COMPANY LIMITED	60
career henan chemical co	58
Nanjing Dolon Biotechnology Co.,Ltd.	58
Hubei xin bonus chemical co. LTD	58
Standardpharm Co. Ltd.	58
Alchem Pharmtech,Inc.	58

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

Update time	Product	Price	Min. Order	Purity	Supply Ability	Manufacturer
2025-07-25	2-METHYL-5-NITROBENZOTRIFLUORIDE 89976-12-5	US $0.00-0.00 / KG	1KG	98.0%	10000KGS	Shaanxi Dideu New Materials Co. Ltd
2025-01-03	2-Methyl-5-nitrobenzotrifluoride 89976-12-5	US $0.00-0.00 / KG	50mg	99%HPLC	2000tons	Shaanxi Dideu Medichem Co. Ltd
2019-07-06	2-METHYL-5-NITROBENZOTRIFLUORIDE 89976-12-5	US $1.00 / KG	1KG	99%	Customized	Career Henan Chemical Co

2-METHYL-5-NITROBENZOTRIFLUORIDE
89976-12-5
US $0.00-0.00 / KG
98.0%
Shaanxi Dideu New Materials Co. Ltd

2-Methyl-5-nitrobenzotrifluoride
89976-12-5
US $0.00-0.00 / KG
99%HPLC
Shaanxi Dideu Medichem Co. Ltd

2-METHYL-5-NITROBENZOTRIFLUORIDE
89976-12-5
US $1.00 / KG
99%
Career Henan Chemical Co

2-METHYL-5-NITROBENZOTRIFLUORIDE Spectrum

2-METHYL-5-NITROBENZOTRIFLUORIDE(89976-12-5)¹HNMR 2-METHYL-5-NITROBENZOTRIFLUORIDE(89976-12-5)FT-IR

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2-METHYL-5-NITROBENZOTRIFLUORIDE 4-NITRO-2-(TRIFLUOROMETHYL)TOLUENE Benzene,1-Methyl-4-nitro-2-(trifluoroMethyl)- 2-Methyl-5-nitrobenzotrifluoride, 97+% 3-TrifluoroMethyl-4-Methylnitrobenzene 4-Nitro-2-(trifluoromethyl)toluene, 4-Methyl-3-(trifluoromethyl)nitrobenzene 4-nitro-2-trifluorotoluen Ponatinib Impurity 6 4-nitro-2-trifluorotoluene 2-methyl-5-nitrotoluene -5-nitrobenzotrifL PotinibImpurity6 Para-methyltrifluoromethylbenzene 89976-12-5 Fluorine series