Methyl 4-bromo-3-methylbenzoate
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Methyl 4-bromo-3-methylbenzoate
structure -
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CAS No:
148547-19-7
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Formula:
C9H9BrO2
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Chemical Name:
Methyl 4-bromo-3-methylbenzoate
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Synonyms:
METHYL 4-BROMO-3-METHYLBENZOATE;METHYL 4-BROMO-M-TOLUATE;Methyl 4-Bromo-3-Methoxynicotinate;Methyl 4-bromo-3-met;2-Bromo-5-(methoxycarbonyl)toluene;4-Bromo-m-toluic Acid Methyl Ester4-Bromo-3-methylbenzoic Acid Methyl EsterMethyl 4-Bromo-m-toluate;2-Bromo-5-(methoxycarbonyl)toluene, Methyl 4-bromo-m-toluate;Methyl 4-broMo-3-Methylbenzoate, 97%, 97%
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CAS No:
Methyl 4-bromo-3-methylbenzoate Basic Attributes
229.07
227.978592
6593534
-0
DTXSID30391150
29163990
Characteristics
26.3
2.8
White to yellow Low Melting Solid or Liquid
1.433±0.06 g/cm3(Predicted)
38-44 °C(lit.)
287.4±20.0 °C(Predicted)
>230 °F
1.545
0.002mmHg at 25°C
Safety Information
NONH for all modes of transport
3
36/37/38
26-36
Xi
Irritant
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Methyl 4-bromo-3-methylbenzoate Use and Manufacturing
To a solution of 4-Bromo-3-methyl-benzoic acid (3 g, 13.19 mmol) in MeOH (15 ml) was added conc. H26d) methyl 4-bromo-3-methylbenzoateAcetyl chloride (20 ml_) was added drop-wise to methanol (100 ml_) during 20 min then the mixture stirred for 5 min. 4-Bromo-3-methylbenzoic acid (16.1 g, 75 mmol) was added and the mixture heated to reflux then stirred for 18 h. The solvent was evaporated and the residue dissolved in EtOAc (300 ml_). This was washed with cold 0.5 M NaOHStep 1:
Computed Properties
Molecular Weight:229.07
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:227.97859
Monoisotopic Mass:227.97859
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Business licensed Certified factoryManufactory Supplier of Active Pharm Ingredients,Chemical Catalyst,Pharmaceutical Intermediates,Flavors and Fragrances,Agrochemicals,Chemical Pesticides,Organic Intermediates,OLED IntermediatesInquiryCAS No.: 148547-19-7Grade: Industrial GradeContent: 99%
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