ChemicalBook > CAS DataBase List > 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER

2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER

Product Name: 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER
CAS No.: 61500-87-6
Chemical Name: 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER
Synonyms: 2-amino-4-(trifluoromethyl)benzoate;Methyl 2-amino-4-(trifluoromethyl)benzoate;Methyl 2-aMino-3-chloro-5-trifluoroMethoxybenzoate;2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER;2-Amino-4-trifluoromethyl-benzoic acid methyl ester 97%;Benzoic acid, 2-aMino-4-(trifluoroMethyl)-, Methyl ester
CBNumber: CB7837216
Molecular Formula: C9H8F3NO2
Formula Weight: 219.16
MOL File: 61500-87-6.mol

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2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER Property

Melting point:: 65-68 °C(Solv: ethanol (64-17-5); water (7732-18-5))
Boiling point:: 267.5±40.0 °C(Predicted)
Density: 1.343±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: soluble in Methanol
form: powder to crystal
pka: 1.06±0.10(Predicted)
color: White to Light yellow to Light orange
InChI: InChI=1S/C9H8F3NO2/c1-15-8(14)6-3-2-5(4-7(6)13)9(10,11)12/h2-4H,13H2,1H3
InChIKey: DZICUHOFOOPVFM-UHFFFAOYSA-N
SMILES: C(OC)(=O)C1=CC=C(C(F)(F)F)C=C1N

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Safety

HS Code: 2922498590

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P337+P313IF eye irritation persists: Get medical advice/attention.

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N-Bromosuccinimide Price

TCI Chemical

Product number: M2905
Product name: Methyl 2-Amino-4-(trifluoromethyl)benzoate
Packaging: 1G
Price: $65
Updated: 2025/07/31

TCI Chemical

Product number: M2905
Product name: Methyl 2-Amino-4-(trifluoromethyl)benzoate
Packaging: 5G
Price: $245
Updated: 2025/07/31

TRC

Product number: A630885
Product name: 2-Amino-4-trifluoromethylbenzoicAcidMethylEster
Packaging: 25g
Price: $275
Updated: 2021/12/16

AK Scientific

Product number: X2838
Product name: Methyl 2-Amino-4-(trifluoromethyl)benzoate
Packaging: 100g
Price: $917
Updated: 2021/12/16

Matrix Scientific

Product number: 074618
Product name: Methyl 2-amino-4-(trifluoromethyl)benzoate
Purity: 95+%
Packaging: 5g
Price: $998
Updated: 2021/12/16

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2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER Chemical Properties,Usage,Production

Uses

2-Amino-4-trifluoromethylbenzoic Acid Methyl Ester is an intermediate used to prepare quinazolinedione sulfonamides as competitive AMPA receptor antagonists. It is also used in the synthesis of (arylamino)pyrimidobenzazepinones and pyrimidobenzazepinethiones as inhibitors of polo-like kinase 1 and potential antitumor agents.

Synthesis

228418-45-9

61500-87-6

Step 2; Preparation of methyl 2-amino-4-trifluoromethylbenzoate; Methyl 2-nitro-4-(trifluoromethyl)benzoate (106 g, 425 mmol) was dissolved in ethanol. To a slurry of 10% palladium carbon (11.0 g) in ethyl acetate (200 mL) was added ethyl acetate (2.2 L), and the suspension was stirred for 3 h at room temperature and 60 °C under a hydrogen atmosphere. Upon completion of the reaction, the suspension was filtered through a Celite pad and the pad was washed with additional ethyl acetate. The filtrate was concentrated under reduced pressure to remove the solvent. The residue was purified by silica gel column chromatography using isohexane/ethyl acetate (9:1) as eluent to afford methyl 2-amino-4-trifluoromethylbenzoate as a white crystalline solid (84 g, 95% yield).

References

[1] Patent: WO2006/2342, 2006, A1. Location in patent: Page/Page column 55-56
[2] Patent: US2004/102636, 2004, A1
[3] Patent: US2008/269265, 2008, A1. Location in patent: Page/Page column 10
[4] Patent: EP1449834, 2004, A2. Location in patent: Page 16
[5] Patent: EP1042305, 2005, B1. Location in patent: Page/Page column 21

2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER manufacturers

Career Henan Chemical Co

Product: 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER 61500-87-6
Price: US $1.00/KG
Min. Order: 1KG
Purity: 99%
Supply Ability: 100kg
Release date: 2019-07-11

61500-87-6, 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTERRelated Search:

Tosyl chloride 2-AMINO-4-(TRIFLUOROMETHYL)BENZOIC ACID ETHYL 2-AMINO-4-TRIFLUOROMETHYLBENZOATE 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER 2-Nitro-4-trifluoromethylbenzoic acid 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID T-BUTYL ESTER 2-[(3-CARBOXYPHENYL)METHYLAMINO]-4-TRIFLUOROMETHYL-BENZOIC ACID T-BUTYL ESTER

2-amino-4-(trifluoromethyl)benzoate

2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER

Methyl 2-amino-4-(trifluoromethyl)benzoate

Methyl 2-aMino-3-chloro-5-trifluoroMethoxybenzoate

Benzoic acid, 2-aMino-4-(trifluoroMethyl)-, Methyl ester

2-Amino-4-trifluoromethyl-benzoic acid methyl ester 97%

61500-87-6

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