Methyl2-bromo-3-methylbenzoate
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Methyl2-bromo-3-methylbenzoate
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CAS No:
131001-86-0
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Formula:
C9H9BrO2
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Chemical Name:
Methyl2-bromo-3-methylbenzoate
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Synonyms:
METHYL 2-BROMO-3-METHYLBENZOATE;2-Bromo-m-toluic acid methyl ester (COOCH3=1);2-Bromo-m-toluic acid methyl ester;2-BROMO-3-METHYL-BENZOIC ACID METHYL ESTER;Methyl 2-Bromo-3-Methoxynicotinate;Methyl 3-Methyl-2-Bromobenzoate;Methyl 2-bromo-3-met;Benzoic acid, 2-bromo-3-methyl-, methyl ester
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CAS No:
Characteristics
26.30000
2.54410
1.433±0.06 g/cm3
267.4±20.0 °C(Predicted)
115.5ºC
1.5530 to 1.5570
Slightly soluble in water.
0.008mmHg at 25°C
Safety Information
|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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
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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