4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER
- Product Name
- 4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER
- CAS No.
- 52787-14-1
- Chemical Name
- 4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER
- Synonyms
- methyl 4-(2-methoxy-2-oxoethyl)benzoate;Homoterephalic acid;DiMethyl hoMoterephthalate;Homoterephthalic Acid Dimethyl Ester;Methyl 4-methoxycarbonylphenylacetate;Methyl 4-methoxy-2-(2-oxoethyl)benzoate;Methyl 4-(methoxycarbonyl)benzeneacetate;4-METHOXYCARBONYLMETHYL-BENZOIC ACID MET...;4-Methoxycarbonylphenylacetic Acid Methyl Ester;4-(2-Methoxy-2-oxoethyl)benzoic Acid Methyl Ester
- CBNumber
- CB5706873
- Molecular Formula
- C11H12O4
- Formula Weight
- 208.21
- MOL File
- 52787-14-1.mol
4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER Property
- Melting point:
- 20 °C
- Boiling point:
- 122°C/0.6mmHg(lit.)
- Density
- 1.155
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Pale Yellow
- InChI
- InChI=1S/C11H12O4/c1-14-10(12)7-8-3-5-9(6-4-8)11(13)15-2/h3-6H,7H2,1-2H3
- InChIKey
- QAQYBHOZQQRJBA-UHFFFAOYSA-N
- SMILES
- C1(CC(OC)=O)=CC=C(C(OC)=O)C=C1
Safety
- HS Code
- 2917.39.7000
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
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.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- D5266
- Product name
- Dimethyl Homoterephthalate
- Purity
- >98.0%(GC)
- Packaging
- 5g
- Price
- $54
- Updated
- 2025/07/31
- Product number
- M329863
- Product name
- 4-Methoxycarbonylmethyl-benzoicAcidMethylEster
- Packaging
- 100mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- J50942
- Product name
- Methyl4-(2-methoxy-2-oxoethyl)benzoate
- Packaging
- 1g
- Price
- $12
- Updated
- 2021/12/16
- Product number
- CHM0166367
- Product name
- 4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER
- Purity
- 98.00%
- Packaging
- 5MG
- Price
- $504.89
- Updated
- 2021/12/16
- Product number
- 119632
- Product name
- Methyl 4-(2-methoxy-2-oxoethyl)benzoate
- Purity
- 95+%
- Packaging
- 100g
- Price
- $990
- Updated
- 2021/12/16
4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER Chemical Properties,Usage,Production
Uses
4-Methoxycarbonylmethyl-benzoic acid methyl ester is an intermediate for the preparation of 10-Propargyl-10-deazaaminopterin with anti tumor activity.
Synthesis
67-56-1
501-89-3
52787-14-1
To the reaction flask was added 4-(carboxymethyl)benzoic acid (5 g, 27.78 mmol), 75 ml of methanol was added to dissolve the raw material and continued with 0.5 ml of N,N-dimethylformamide and thionyl chloride (6 ml, 83.33 mmol). The reaction was carried out at 50°C for 4 hours. After completion of the reaction, most of the thionyl chloride and methanol were removed by rotary evaporation. The residue was dissolved in 200 ml of ethyl acetate and washed sequentially with saturated sodium carbonate solution (50 ml x 3) and saturated brine (50 ml x 3). The organic phase was dried with anhydrous sodium sulfate, filtered and concentrated by rotary evaporation to give 5.5 g of a colorless transparent liquid product, methyl 4-formate phenylacetate, in 95.2% yield.
References
[1] Patent: CN105541777, 2016, A. Location in patent: Paragraph 0015; 0059; 0060; 0061
[2] Journal of Medicinal Chemistry, 1997, vol. 40, # 3, p. 377 - 384
[3] Patent: WO2015/100363, 2015, A1. Location in patent: Page/Page column 52; 53
[4] Patent: CN103739604, 2016, B. Location in patent: Paragraph 0037-0038
[5] Journal of the Indian Chemical Society, 1987, vol. 64, # 1, p. 34 - 37
4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER manufacturers
- Product
- 4-METHOXYCARBONYLMETHYL-BENZOIC ACID METHYL ESTER 52787-14-1
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- Customized
- Release date
- 2018-08-20