| Identification | More | [Name]
Methyl 3-amino-4-methylbenzoate | [CAS]
18595-18-1 | [Synonyms]
3-AMINO-4-METHYLBENZOIC ACID METHYL ESTER
3-AMINO-P-TOLUIC ACID METHYL ESTER
AKOS BB-3092
LABOTEST-BB LT00848257
METHYL 3-AMINO-4-METHYLBENZOATE
METHYL 3-AMINO-P-TOLUATE
3-Amino-p-Toluic Acid Methyl Ester 3-Amino-4-Methyl Benzoic Acid Methyl Ester
3-Amino-4-Methylbenzoate
3-Amino-p-toluic
Methyl 3-amino-4-methylbenzoate 98%
Methyl 3-Amion-4-Methylbenzoate
Methyl4-Methyl-3-Aminobenzoate | [EINECS(EC#)]
606-067-8 | [Molecular Formula]
C9H11NO2 | [MDL Number]
MFCD00025206 | [Molecular Weight]
165.19 | [MOL File]
18595-18-1.mol |
| Chemical Properties | Back Directory | [Melting point ]
113-117 °C(lit.)
| [Boiling point ]
296.3±20.0 °C(Predicted) | [density ]
1.132±0.06 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Inert atmosphere,Room temperature | [solubility ]
Chloroform (Slightly), Methanol (Slightly) | [form ]
Crystalline Powder | [pka]
3.31±0.10(Predicted) | [color ]
White to cream | [BRN ]
2088611 | [InChIKey]
YEPWCJHMSVABPQ-UHFFFAOYSA-N | [LogP]
1.7 at 22℃ and pH7 | [CAS DataBase Reference]
18595-18-1(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves . | [WGK Germany ]
3
| [Hazard Note ]
Irritant | [HS Code ]
29224999 |
| Hazard Information | Back Directory | [Description]
Methyl 3-amino-4-methylbenzoate(18595-18-1) is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
| [Chemical Properties]
Beige powder | [Uses]
Methyl 3-Amino-4-methylbenzoate(18595-18-1) is used as a reagent in the synthesis of perfluoroalkylated indoles which are very useful in drug development. It was also used in the preparation of 4-(pyrimidin-2-ylamino) benzamide derivatives which are designed as inhibitors of hedgehog signalling pathway (target of cancer treatment).
| [Application]
Methyl 3-amino-4-methylbenzoate(18595-18-1) can be used for:
To prepare the methyl 4-methyl-3-((4-(proparg-1-yloxy)benzyl)amino)benzoate, 4-proparg-1-yloxybenzaldehyde (16) and methyl 3-amino-4-methylbenzoate were reacted according to the method IA.
Synthesis of Methyl 4-methyl-3-((4-(2-methylthiazol-4-yl)benzoyl)amino)benzoate
Synthesis of 4-Methyl-3-((4-(2-methylthiazol-4-yl)benzoyl)amino)benzamide
Synthesis of methyl 3-(4-hydroxy-6-methyl-2-oxopyridin-1 (2H)-yl)-4-methylbenzoate
Synthesis of (5-Carbomethoxy-2-methylphenyl)(4-hydroxypheny)diazene: To a solution of 6N HC1 (6 mL) was added methyl 3-amino-4-methylbenzoate (1.62 g, 10.0 mmol). The solution was cooled in an ice-bath, and was diazotized by adding sodium nitrite (0.9 g, 12.0 mmol). To a cold solution of phenol in 21% aqueous NaOH solution (6 mL) was added diazotized solution slowly. After 20 min, the solution was acidfied by adding 4 N aqueous HC1 and was poured into the cold water, filtered, and washed with water. Recrystallization from ethanol gave the product (2.0 g, 74%) as red crystals, mp 181.3-182.2 °C.
| [Definition]
ChEBI: Methyl 3-amino-4-methylbenzoate is a benzoate ester. | [Preparation]
Synthesis of Methyl 3-amino-4-methylbenzoate(18595-18-1): Nitro ester Methyl 4-methyl-3-nitrobenzoate (80 g, 0.410 mol) was subjected to hydrogenation in a Parr shaker in MeOH using Raney Ni as the catalyst (5 g, 20 mol %) at 50 psi for 8 hours. The catalyst was filtered off, washed thoroughly with MeOH and the combined filtrates concentrated under reduced pressure to furnish a yellow solid (65.0 g). Yield : 96% Mp : 114-5°C (lit.14 Mp 116°C)
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