CAS Number: 77451-51-5
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CAS Number
77451-51-5
PubChem CID
688072
Molecular Formula
C9H8N4O4S
Molecular Weight
268.25 g/mol
Exact Mass
268.026626
InChIKey
ZQMJAWSQRGYFBM-UHFFFAOYSA-N
IUPAC Name
1-(4-methylphenyl)sulfonyl-3-nitro-1,2,4-triazole
SMILES String
CC1=CC=C(C=C1)S(=O)(=O)N2C=NC(=N2)[N+](=O)[O-]
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Structural features
1-(p-Toluenesulfonyl)-3-nitro-1,2,4-triazole (CAS 77451-51-5) is listed in the Advanced Chemicals portfolio, with molecular formula C9H8N4O4S and molecular weight 268. 25 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
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Preliminary Safety Reference
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Safety Reference / SDS RequestCatalog navigation
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1-(p-Toluenesulfonyl)-3-nitro-1,2,4-triazole is identified by CAS 77451-51-5, with molecular formula C9H8N4O4S, molecular weight 268.25, InChIKey ZQMJAWSQRGYFBM-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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