| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 31st, 2006 | 24 | Yes |
Popular Name: Quinine sulfate dihydrate Quinine sulfate dihydrate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 130-89-2 , 130-95-0 , 146-40-7 , 303137-00-0 , 60-93-5 , 6119-47-7 , 6119-70-6 , [130-95-0] , [549-56-4]
"Quinine hydrochloride dihydrate, 99%"
(-)-Quinine; 130-95-0; C06526; Quinine
(1R)-(6-Methoxyquinolin-4-yl)((1S,4S,5R)-5-vinylquinuclidin-2-yl)methanol
(3|A,8|A,9r)-6'-methoxycinchonan-9-ol
(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol
(8-alpha,9R)-6'-Methoxycinchonan-9-ol
(8.alpha.,9R)-6'-Methoxycinchonan-9-ol
(8S,9R)-6'-Methoxycinchonan-9-ol
(9R)-6'-methoxy-8alpha-cinchonan-9-ol
(R)-(-)-Quinine, 6-methoxycinchonidine
(R)-(6-Methoxy-quinolin-4-yl)-((2S,5S)-5-vinyl-1-aza-bicyclo[2.2.2]oct-2-yl)-methanol
(R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol
(R)-[(2S,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
(R)-[(2S,4R,5R)-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
(R)-[(2S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
(S)-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol
(S)-[(2R,4R,5S)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
.alpha.-(6-Methoxy-4-quinoyl)-5-vinyl-2-quinclidinemethanol
146-40-7; D05681; Quinine ascorbate (USAN)
2-Quinuclidinemethanol, .alpha.-(6-methoxy-4-quinolyl)-5-vinyl-
2-Quinuclidinemethanol, alpha-(6-methoxy-4-quinolyl)-5-vinyl-
60-93-5; D08461; Quinine (TN); Quinine dihydrochloride
Biquinate (*Bisulfate heptathydrate*)
cinchonan-9-ol, 6'-methoxy-, (3a,4b,8a,9R)-, sulfate, hydrate (2:1:2) (salt)
Cinchonan-9-ol, 6'-methoxy-, (8-alpha,9R)-
Cinchonan-9-ol, 6'-methoxy-, (8.alpha.,9R)-
Cinchonan-9-ol, 6'-methoxy-, (8.alpha.,9R)-, sulfate
Cinchonan-9-ol, 6'-methoxy-, (8alpha,9R)-
Cinchonan-9-ol, 6'-methoxy-, (9S)-
Dentojel (*Bisulfate heptathydrate*)
NF); Quinine Ascorbate (USAN); Quinine Phosphate (NF); Quinine Bisulfate (MI
NF); Quinine Dihydrochloride (MI
NF); Quinine Glycerophosphate (NF)
NF); Quinine Glycerophosphate (NF); Quinine Hydrobromide (MI
NF); Quinine Hydrochloride (JAN
NF); Quinine Phosphate (NF); Quinine Ascorbate (USAN); Quinine Dihydrochloride (MI
Quinamm (*2:1 Sulfate salt*), dihydrate
Quine (*2:1 Sulfate salt*, dihydrate)
QUININE ANHYDROUS, FOR FLUORESCENCE
QUININE ANHYDROUS, FOR FLUORESCENCE, 98.0%+
Quinine hemisulfate monohydrate
Quinine hemisulfate monohydrate, 99%
Quinine hydrochloride dihydrate
Quinine monohydrochloride dihydrate, 99% (total base), may contain up to 10% Dihydroquinine
Quinine sulfate (2:1) (salt) dihydrate
Quinine sulfate dihydrate, specified according to the requirements of USP
Quinine sulfate salt monohydrate
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.06 | 7.16 | -39.94 | 2 | 4 | 1 | 47 | 325.432 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | 7.59 | -89.89 | 3 | 4 | 2 | 48 | 326.44 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 5.473 | Bitter DB |
| MP | 168-172 °C(lit.) | Indofine |
| Mp [°C] | 176 - 177 | Acros Organics |
| Melting_Point | 217-218? dec. | Alfa-Aesar |
| Melting_Point | 217-218° dec. | Alfa-Aesar |
| Purity | 99% | APIChem |
| PUBCHEM_PATENT_ID | EP0148811A1; EP0293347A1; EP0293347B1; EP0326278A1; EP0351897A2; EP0371493A1; EP0371493B1; US3965256; US4189426; US4235870; US4780318; US5001161; US5081154; US5174998; US6099864; WO1989012391A1; WO1999059554A1 | IBM Patent Data |
| H phrase | H302: Harmful if swallowed; H312: Harmful in contact with skin; H332: Harmful if inhaled; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H302: Harmful if swallowed; H335: May cause respiratory irritation; H317: May cause an allergic skin reaction; H334: May cause allergy or asthma symptoms or breathing difficulties if inhal | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P280: Wear eye protection/face protection | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin.; R42/43: May cause sensitisation by inhalation and skin contact. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
