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171869-95-7

Basic Information
CAS No.: 171869-95-7
Name: Palmatine chloride hydrate
Molecular Structure:
Molecular Structure of 171869-95-7 (Palmatine chloride hydrate)
Formula: C21H22ClNO4.H2O
Molecular Weight: 405.87
Synonyms: Dibenzo[a,g]quinolizinium,5,6-dihydro-2,3,9,10-tetramethoxy-, chloride, monohydrate (9CI);palmatine hydrochloride;
Melting Point: 206-207 ºC (dec.)
Flash Point: 113 ºC
Hazard Symbols: HarmfulXn
Risk Codes: 20/22-36/38
Safety: 24-45
Transport Information: UN 2811
PSA: 50.03000
LogP: 0.32450
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  • Palmatine chloride hydrate  CAS NO.171869-95-7

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    Palmatine chloride hydrate CAS NO.171869-95-7

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    Palmatine chloride hydrate (Palmatine) is an alkaloid. It is a potential phototoxin, and exhibits low quantum yields for fluorescence. Normal Raman spectra and DFT calculations of palmatine chloride hydrate is reported. Package:100 mg in clear glass

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Specification

The systematic name of Palmatine chloride hydrate is 2,3,9,10-tetramethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium chloride hydrate . With the CAS registry number  171869-95-7, it is also named as 2,3,9,10-Tetramethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium chloride hydrate (1:1:1) ; Dibenzo[a,g]quinolizinium, 5,6-dihydro-2,3,9,10-tetramethoxy-, chloride, hydrate (1:1:1) . The product's categories are Building Blocks, Heterocyclic Building Blocks and Isoquinolines. It is soluble in hot water.

The Palmatine chloride hydrate is used as pharmaceutical intermediates. A protoberberine alkaloid that is isolated from medicinal herbs like Coptis chinensis Franch. Sedative effect of palmatine is related to its ability to inhibit dopamine generation. It also acts as a selective topoisomerase I and II position and as vasodilator that effectively reduces Ca2+ concentration.

The Palmatine chloride hydrate is harmful by inhalation and if swallowed. It is irritating to eyes and skin. Avoid contact with skin. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

The other characteristics of this product can be summarized as: (1) #H bond acceptors: 6; (2) #H bond donors: 2; (3) #Freely Rotating Bonds:  4; (4) Polar Surface Area:  50.03. People can use the following data to convert to the molecule structure. SMILES: [Cl-].O.O(c4cc3c2cc1ccc(OC)c(OC)c1c[n+]2CCc3cc4OC)C; InChI: InChI=1/C21H22NO4.ClH.H2O/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4;;/h5-6,9-12H,7-8H2,1-4H3;1H;1H2/q+1;;/p-1.