Lot numbers can be found on the outside label of a product:
Amodiaquine impurity 1
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CAS No. 81099-86-7
- Cat. No. CS-W009443
- Purity≥98%
- MDL No.MFCD00034449
*For research and further manufacturing use only, not for direct human use.
Structure of 81099-86-7
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General Information
- CAS No. 81099-86-7
- Cat. No. CS-W009443
- Purity ≥98%
- MDL No. MFCD00034449
- Storage 4°C, protect from light, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₅H₁₁ClN₂O
- Molecular Weight 270.72
- Synonym(s) None
- SMILES OC1=CC=C(NC2=CC=NC3=CC(Cl)=CC=C23)C=C1
Description
4-((7-Chloroquinolin-4-yl)amino)phenol features a quinoline scaffold bearing a chloro substituent at the 7-position and a primary amino linkage to a phenolic ring. This arrangement imparts enhanced electron density at the amine site, facilitating conjugation in bioactive molecule design. The compound exhibits good solubility in polar organic solvents and stability under standard bench conditions, making it suitable for use in pharmaceutical intermediates and fluorescent probe development.
Application
4-((7-Chloroquinolin-4-yl)amino)phenol serves as a versatile building block in medicinal chemistry, enabling the construction of quinoline-based scaffolds prevalent in kinase inhibitors and antimalarial agents. Its amino-phenol functionality offers orthogonal reactivity for derivatization via coupling, acylation, or cyclization reactions. The molecule exhibits good bench stability and facilitates straightforward purification, making it suitable for scalable synthesis and lead optimization campaigns.
Synthesis
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Route1
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In-stock
86-98-6 -
123-30-8 - ~97%
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In-stock
81099-86-7
References
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INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM); UNIVERSITE LILLE 2 DROIT ET SANTE; DELACOURTE, Andre; MELNYK, Patricia; BURLET, Stephane; LEFUR, Nicolas Patent: WO2011/73322 A1, 2011 ; Location in patent: Page/Page column 37 ;
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Route2
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In-stock
86-98-6
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3648-96-2
- ~%
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In-stock
81099-86-7
References
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Stawrowskaja Zhurnal Obshchei Khimii, 1955 , vol. 25, p. 331,335; engl. Ausg. S. 313, 316 Full Text Show Details Burckhalter et al. Journal of the American Chemical Society, 1948 , vol. 70, p. 1363,1372 Journal of the American Chemical Society, 1950 , vol. 72, p. 1024
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Route3
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In-stock
86-98-6
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51-78-5
- ~%
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In-stock
81099-86-7
References
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Stawrowskaja Zhurnal Obshchei Khimii, 1955 , vol. 25, p. 331,335; engl. Ausg. S. 313, 316 Full Text Show Details Burckhalter et al. Journal of the American Chemical Society, 1948 , vol. 70, p. 1363,1372 Journal of the American Chemical Society, 1950 , vol. 72, p. 1024
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS05
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Signal Word : Danger
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UN#: 3261
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Class : 8
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Packing Group : Ⅲ
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Hazard Statements : H302-H315-H318-H335-H413
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Precautionary Statements : P280-P302+P352-P330
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Quality Control
Computational Chemistry Data
- TPSA 45.15
- LogP 4.3374
- H_Acceptors 3
- H_Donors 2
- Rotatable_Bonds 2
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