Lot numbers can be found on the outside label of a product:
5-Nitro-1H-indazol-3-amine
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CAS No. 41339-17-7
- Cat. No. CS-0019180
- Purity≥98%
- MDL No.MFCD00179824
*For research and further manufacturing use only, not for direct human use.
Structure of 41339-17-7
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General Information
- CAS No. 41339-17-7
- Cat. No. CS-0019180
- Purity ≥98%
- MDL No. MFCD00179824
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₆N₄O₂
- Molecular Weight 178.15
- Synonym(s) 5-Nitro-1H-indazol-3-amine; 3-Amino-5-nitro-1H-indazole; 3-Amino-5-nitroindazole; 5-Nitro-1H-indazol-3-ylamine; 5-nitroindazol-3-aMine
- SMILES NC1=NNC2=C1C=C([N+]([O-])=O)C=C2
Description
5-Nitro-1H-indazol-3-amine delivers a potent electron-deficient heterocyclic scaffold ideal for constructing bioactive molecules. The para-nitro group enhances reactivity in cross-coupling processes, while the primary amine enables facile derivatization. This bench-stable compound integrates seamlessly into medicinal chemistry campaigns targeting kinase inhibitors and antiparasitic agents.
Application
5-Nitro-1H-indazol-3-amine serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles through standard functional group manipulations. Its nitro and amine groups offer orthogonal reactivity for selective transformations, including reduction, coupling, and cyclization reactions. The molecule exhibits good bench stability and facilitates efficient purification, making it well-suited for iterative synthesis campaigns in drug discovery.
Synthesis
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Route1
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In-stock
17417-09-3 - ~%
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In-stock
41339-17-7
References
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Krishnamurty, Ratika; Brock, Amanda M.; Maly, Dustin J. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 1 p. 550 - 554
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Route2
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1219024-62-0 - ~88%
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In-stock
41339-17-7
References
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Lefebvre, Valerie; Cailly, Thomas; Fabis, Frederic; Rault, Sylvain Journal of Organic Chemistry, 2010 , vol. 75, # 8 p. 2730 - 2732
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Route3
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In-stock
874-05-5 - ~%
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In-stock
41339-17-7
References
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Gorelik; Lomzakova; Khamidova; Kuznetsova Russian Journal of Organic Chemistry, 1996 , vol. 32, # 11 p. 1682 - 1689
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 97.84
- LogP 1.0533
- H_Acceptors 4
- H_Donors 2
- Rotatable_Bonds 1
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Key Words
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