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168899-61-4

168899-61-4 Structure

168899-61-4 Structure
IdentificationBack Directory
[Name]

3-AMINO-2-BROMO-BENZOIC ACID
[CAS]

168899-61-4
[Synonyms]

2-Bromo-3-carboxyaniline
3-AMINO-2-BROMO-BENZOIC ACID
Benzoic acid, 3-amino-2-bromo-
3-Amino-2-bromobenzoic acid 95%
[Molecular Formula]

C7H6BrNO2
[MDL Number]

MFCD07786957
[MOL File]

168899-61-4.mol
[Molecular Weight]

216.03
Chemical PropertiesBack Directory
[Melting point ]

153-158℃
[Boiling point ]

367.4±32.0 °C(Predicted)
[density ]

1.793±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

powder
[pka]

3.01±0.10(Predicted)
[color ]

Dark peach/salmon
[Major Application]

peptide synthesis
[InChI]

1S/C7H6BrNO2/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3H,9H2,(H,10,11)
[InChIKey]

PAGROCHVTXMVTP-UHFFFAOYSA-N
[SMILES]

Nc1cccc(C(O)=O)c1Br
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P301+P310
[Hazard Codes ]

Xn
[Risk Statements ]

22
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

nwg
[HS Code ]

2922498590
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Hazard InformationBack Directory
[Uses]

3-Amino-2-bromobenzoic Acid acts as HIV protease inhibitor. 3-Amino-2-bromobenzoic Acid is a derivative of Benzoic Acid (B203900). Benzoic Acid is used in the synthesis of selective human A3 adenosine receptor antagonists.
Spectrum DetailBack Directory
[Spectrum Detail]

3-AMINO-2-BROMO-BENZOIC ACID(168899-61-4)1HNMR
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