8.22194
(-)-Quinine hydrochloride dihydrate
for synthesis
别名:
(-)-Quinine hydrochloride dihydrate
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关于此项目
经验公式（希尔记法）:
C20H25ClN2O2 · 2H2O
化学文摘社编号:
分子量:
396.91
MDL number:
UNSPSC Code:
12352107
EC Index Number:
205-001-1
NACRES:
NA.22
eCl@ss:
32039090
Assay:
≥99.0% (acidimetric)
Form:
powder
Quality Segment
assay
≥99.0% (acidimetric)
form
powder
potency
620 mg/kg LD50, oral (Rat)
reaction suitability
reagent type: chrial catalyst
pH
6.0 (20 °C, 10 g/L in H2O)
mp
115 °C (decomposition)
transition temp
flash point 122 °C
solubility
62.5 g/L
bulk density
310 kg/m3
storage temp.
2-30°C
SMILES string
Cl.N21[C@@H](C[C@H]([C@H](C2)C=C)CC1)[C@H](O)c3c4c(ncc3)ccc(c4)OC.O.O
InChI
1S/C20H24N2O2.ClH.2H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1H;2*1H2/t13-,14+,19-,20+;;;/m0.../s1
InChI key
MPQKYZPYCSTMEI-FXXIJDEQSA-N
Analysis Note
Assay (acidimetric): ≥ 99.0 %
Spec. rotation [α²0/D (calculated on dried substance): -258.0 - -245.0 °
Identity (IR): passes test
Spec. rotation [α²0/D (calculated on dried substance): -258.0 - -245.0 °
Identity (IR): passes test
警示词
Danger
Hazard Classifications
Acute Tox. 4 Oral - Resp. Sens. 1 - Skin Sens. 1
存储类别
11 - Combustible Solids
WGK
WGK 1
闪点 (F)
Not applicable
闪点 (°C)
Not applicable
