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About This Item
Empirical Formula (Hill Notation):
C7H5N3O2S
CAS Number:
Molecular Weight:
195.20
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
97%
mp
250 °C (dec.) (lit.)
SMILES string
Nc1nsc2ccc(cc12)[N+]([O-])=O
InChI
1S/C7H5N3O2S/c8-7-5-3-4(10(11)12)1-2-6(5)13-9-7/h1-3H,(H2,8,9)
InChI key
LDTCWISGJYTXDC-UHFFFAOYSA-N
Related Categories
General description
3-Amino-5-nitrobenzisothiazole forms 1:1 complex with β-cyclodextrin (β-CDx). Structural and photoprototropic features of this complex have been investigated.
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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R Rajamohan et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 69(2), 371-377 (2007-07-03)
The inclusion complexation and photoprototropic behaviour of 3-amino-5-nitrobenzisothiazole (ANBT) in aqueous beta-cyclodextrin (beta-CDx) solution have been investigated. Absorption and fluorescence intensities of the neutral form of ANBT are enhanced due to the formation of 1:1 complex with beta-CDx. The complex
Theoretical study of inclusion complexation of 3-amino-5-nitrobenzisothiazole with ?-cyclodextrin.
Leila N, et al.
Journal of Molecular Liquids, 160(1), 8-13 (2011)
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