3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER

Product Name: 3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER
CAS No.: 478375-40-5
Chemical Name: 3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER
Synonyms: Methyl 3-broMo-5-Methylbenzoate;3-bromo-5-methylbenzoate methyl;3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER;Benzoic acid, 3-bromo-5-methyl-, methyl ester
CBNumber: CB22455116
Molecular Formula: C9H9BrO2
Formula Weight: 229.07
MOL File: 478375-40-5.mol

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3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER Property

Boiling point:: 271.8±20.0℃ (760 Torr)
Density: 1.433±0.06 g/cm3 (20 ºC 760 Torr)
Flash point:: 118.2±21.8℃
storage temp.: Sealed in dry,Room Temperature
form: solid
color: Yellow
InChI: InChI=1S/C9H9BrO2/c1-6-3-7(9(11)12-2)5-8(10)4-6/h3-5H,1-2H3
InChIKey: OAOZBFUAVJUPED-UHFFFAOYSA-N
SMILES: C(OC)(=O)C1=CC(C)=CC(Br)=C1

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Safety

HS Code: 2916310090

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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

TRC

Product number: M296053
Product name: Methyl3-bromo-5-methylbenzoate
Packaging: 100mg
Price: $45
Updated: 2021/12/16

American Custom Chemicals Corporation

Product number: HCH0063232
Product name: 3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER
Purity: 95.00%
Packaging: 5MG
Price: $502.73
Updated: 2021/12/16

Apolloscientific

Product number: OR400190
Product name: Methyl3-bromo-5-methylbenzoate
Packaging: 5g
Price: $282
Updated: 2021/12/16

SynQuest Laboratories

Product number: 2723-9-20
Product name: Methyl 3-bromo-5-methylbenzoate
Packaging: 5G
Price: $311
Updated: 2021/12/16

AK Scientific

Product number: AMTH216
Product name: Methyl3-bromo-5-methylbenzoate
Packaging: 25g
Price: $315
Updated: 2021/12/16

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3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER Chemical Properties,Usage,Production

Chemical Properties

off-white powder

Synthesis

67-56-1

58530-13-5

478375-40-5

Methanol (1.104 g, 0.035 mol) was slowly added to a solution of 3-bromo-5-methylbenzoic acid (5 g, 0.023 mol) in dichlorosulfoxide (30 mL) at 0 °C. The reaction mixture was warmed to 80 °C and stirred for 2 hours. Upon completion of the reaction, the mixture was cooled to 18 °C and concentrated by rotary evaporation to remove the solvent. The residue was washed with water (20 mL) and subsequently extracted with ethyl acetate (100 mL). The organic phase was dried over anhydrous sodium sulfate, filtered and concentrated to afford methyl 3-bromo-5-methylbenzoate (5.3 g, 93.8% yield).LC-MS (mass spectrometry) analysis showed the molecular ion peak of the target product to be 229 [M + 1].

References

[1] Patent: US2015/197493, 2015, A1. Location in patent: Paragraph 0871; 0872; 0873; 0874
[2] Journal of Medicinal Chemistry, 2018, vol. 61, # 16, p. 7358 - 7373
[3] Patent: US2015/225355, 2015, A1. Location in patent: Paragraph 0868; 0869

3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER Preparation Products And Raw materials

Raw materials

Preparation Products

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3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER Suppliers

China 69 India 1 Switzerland 1 United Kingdom 2 United States 9 Global 82

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478375-40-5, 3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTERRelated Search:

DIMETHYL 5-BROMOISOPHTHALATE METHYL 5-BROMO-2-METHOXY-3-METHYLBENZENECARBOXYLATE CHEMBRDG-BB 9033713 ETHYL 4-AMINO-3-BROMO-5-CYANO-2-HYDROXYBENZOATE METHYL 2-AMINO-5-BROMO-3-METHYLBENZENECARBOXYLATE 5-TERT-BUTYL METHYLISOPHTHALATE METHYL-3-TERT-BUTYL-5-BROMO-BENZOATE 10-BROMO-2,2,6,6-TETRAMETHYL-2H-1,5,7-TRIOXA-PHENANTHREN-8-ONE 5-BROMO-2-OXYINDOLE-7-CARBOXYLIC ACID METHYL ESTER AURORA KA-6176 RARECHEM AL BW 1748 RARECHEM AL BI 1427 METHYL 4-AMINO-3-BROMO-5-METHYLBENZENECARBOXYLATE RARECHEM AL BI 1433 RARECHEM AL BF 1427 8-bromo-2,6-dimethyl-4H-3,1-benzoxazin-4-one RARECHEM AL BF 1433 METHYL-2,7-DIBROMO-9-FLUORENONE-4-CARBOXYLATE

3-BROMO-5-METHYL-BENZOIC ACID METHYL ESTER

Methyl 3-broMo-5-Methylbenzoate

Benzoic acid, 3-bromo-5-methyl-, methyl ester

3-bromo-5-methylbenzoate methyl

478375-40-5