Lot numbers can be found on the outside label of a product:
Isoquinolin-8-amine
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CAS No. 23687-27-6
- Cat. No. CS-W004819
- Purity≥97%
- MDL No.MFCD00179553
*For research and further manufacturing use only, not for direct human use.
Structure of 23687-27-6
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General Information
- CAS No. 23687-27-6
- Cat. No. CS-W004819
- Purity ≥97%
- MDL No. MFCD00179553
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₈N₂
- Molecular Weight 144.17
- Synonym(s) 8-Aminoisoquinoline
- SMILES NC2=C1C=NC=CC1=CC=C2
Description
Isoquinolin-8-amine delivers a rigid, electron-rich heteroaromatic scaffold ideal for constructing bioactive molecules. This bench-stable amine integrates readily into pharmaceutical intermediates and functional materials, leveraging its nitrogen-directed reactivity for efficient coupling and derivatization under standard conditions.
Application
Isoquinolin-8-amine serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles through standard coupling and functionalization reactions. Its nitrogen-rich scaffold exhibits favorable solubility and stability under routine synthetic conditions, facilitating efficient derivatization for drug discovery applications.
Synthesis
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Route1
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In-stock
63927-23-1 - ~69%
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In-stock
23687-27-6
References
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Gomtsyan, Arthur; Bayburt, Erol K.; Schmidt, Robert G.; Guo, Zhu Zheng; Perner, Richard J.; Didomenico, Stanley; Koenig, John R.; Turner, Sean; Jinkerson, Tammie; Drizin, Irene; Hannick, Steven M.; Macri, Bryan S.; McDonald, Heath A.; Honore, Prisca; Wismer, Carol T.; Marsh, Kennan C.; Wetter, Jill; Stewart, Kent D.; Oie, Tetsuro; Jarvis, Michael F.; Surowy, Carol S.; Faltynek, Connie R.; Lee, Chih-Hung Journal of Medicinal Chemistry, 2005 , vol. 48, # 3 p. 744 - 752
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Route2
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401916-13-0 - ~83%
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In-stock
23687-27-6
References
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Gamage, Swarna A.; Spicer, Julie A.; Rewcastle, Gordon W.; Milton, John; Sohal, Sukhjit; Dangerfield, Wendy; Mistry, Prakash; Vicker, Nigel; Charlton, Peter A.; Denny, William A. Journal of Medicinal Chemistry, 2002 , vol. 45, # 3 p. 740 - 743
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Route3
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In-stock
119-65-3 - ~%
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In-stock
23687-27-6
References
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Journal of Medicinal Chemistry, , vol. 48, # 15 p. 4972 - 4982
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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 38.91
- LogP 1.817
- H_Acceptors 2
- H_Donors 1
- Rotatable_Bonds 0
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