2-Amino-3-bromobenzoic acid
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2-Amino-3-bromobenzoic acid
structure -
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CAS No:
20776-51-6
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Formula:
C7H6BrNO2
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Chemical Name:
2-Amino-3-bromobenzoic acid
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Synonyms:
Benzoic acid,2-amino-3-bromo-;Anthranilic acid,3-bromo-;2-Amino-3-bromobenzoic acid;3-Bromoanthranilic acid;NSC 112517;3-Bromo-2-aminobenzoic acid
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CAS No:
2-Amino-3-bromobenzoic acid Basic Attributes
216.03
216.03
1533716-785-6
112517
DTXSID50296895
2922499990
Safety Information
UN 2811 6.1 / PGIII
3
22-36/37/38-25
26-36/37/39-45
Xi,Xn,T
Irritant
P301 + P310
H301
|Danger|H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 42 companies from 5 notifications to the ECHA C&L Inventory.
2-Amino-3-bromobenzoic acid Use and Manufacturing
Commercially available 7-bromoisatin (18.0 g, 79.6 mmol) was dissolved in a 5percent sodium hydroxide aqueous solution (400 mL), and 30percent hydrogen peroxide water (22.5 mL, 199 mmol) was dropped at 50°C. The mixture was stirred at 50°C for 30 minutes. The reaction mixture was cooled to room temperature, and neutralized with 2.0 mol/L hydrochloric acid. The precipitated crystals were collected by filtration, and dried overnight under reduced pressure to give 2-amino-3-bromobenzoic acid144C. 2-Amino-3-bromo-benzoic acid.; H
2-Amino-3-bromobenzoic acid is used to synthesize pharmaceutical intermediates.
Computed Properties
Molecular Weight:216.03
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:214.95819
Monoisotopic Mass:214.95819
Topological Polar Surface Area:63.3
Heavy Atom Count:11
Complexity:163
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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CN
5 YRS
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