Description
2-Bromo-6-nitrobenzothiazole (CAS No. 2516-37-2) is a high-purity heterocyclic organic compound with the molecular formula C7H3BrN2O2S. This benzothiazole derivative is characterized by its bromo and nitro functional groups, making it a versatile intermediate for synthetic organic chemistry and pharmaceutical research. With an IUPAC name of 2-bromo-6-nitro-1,3-benzothiazole, this compound is supplied as a crystalline solid with guaranteed purity suitable for advanced research applications. Its unique structure enables applications in the development of fluorescent probes, agrochemicals, and bioactive molecules. Store in a cool, dry place away from light and moisture to ensure stability.
Properties
- CAS Number: 2516-37-2
- Complexity: 223
- IUPAC Name: 2-bromo-6-nitro-1,3-benzothiazole
- InChI: InChI=1S/C7H3BrN2O2S/c8-7-9-5-2-1-4(10(11)12)3-6(5)13-7/h1-3H
- InChI Key: OEDLGBGVVRSXGG-UHFFFAOYSA-N
- Exact Mass: 257.90986
- Molecular Formula: C7H3BrN2O2S
- Molecular Weight: 259.08
- SMILES: C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)Br
- Topological: 87
- Monoisotopic Mass: 257.90986
- Synonyms: 2-Bromo-6-nitrobenzothiazole, 2516-37-2, DTXSID40469617, DTXCID90420435, 813-939-3, 2-bromo-6-nitro-1,3-benzothiazole, 2-bromo-6-nitrobenzo[d]thiazole, Benzothiazole, 2-bromo-6-nitro-, C7H3BrN2O2S, 2-bromo-6-nitro-benzothiazole, MFCD07783787, BENZOTHIAZOLE,2-BROMO-6-NITRO-, 2-Bromo-6-nitrobenzthiazole, SCHEMBL1636840, OEDLGBGVVRSXGG-UHFFFAOYSA-N, BCP27002, CAA51637, SBB102126, AKOS005073159, KA-0928, AC-15099, DB-000841, CS-0096143, EN300-68855, F17130, F9994-5372, Z1097111303
Application
2-Bromo-6-nitrobenzothiazole serves as a key intermediate in the synthesis of benzothiazole-based fluorophores for bioimaging and sensor development. It is utilized in pharmaceutical research for constructing heterocyclic scaffolds with potential biological activity. Additionally, this compound finds use in materials science for designing nitroaromatic-based functional materials.
Safety and Hazards
GHS Hazard Statements
- H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
- H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
- H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statements
- P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Hazard Classes and Categories
- Skin Irrit. 2 (100%)
- Eye Irrit. 2 (100%)
- STOT SE 3 (100%)
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