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| CAS No.: | 1953-04-4 |
|---|---|
| Name: | Galantamine Hydrobromide |
| Article Data: | 13 |
| Molecular Structure: | |
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| Formula: | C17H21NO3.HBr |
| Molecular Weight: | 368.271 |
| Synonyms: | Galantamine Hbr / Hcl;Galanthamine hydrobromide #;Galantamine HBr;Galanthamine HBr; |
| EINECS: | 217-780-5 |
| Melting Point: | 256 °C |
| Boiling Point: | 439.3 °C at 760 mmHg |
| Flash Point: | 219.5 °C |
| Solubility: | Soluble in water or DMSO |
| Appearance: | white to offf-white powder |
| Hazard Symbols: |
 T
|
| Risk Codes: | 25 |
| Safety: | 36/37/39-22-45 |
| Transport Information: | UN 2811 6.1/PG 3 |
| PSA: | 41.93000 |
| LogP: | 2.74630 |
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Specification
The Galanthamine hydrobromide, with its CAS registry number 1953-04-4, has the systematic name of galanthamine hydrobromide (1:1). And being a kind of white to offf-white powder, its product categories are including Alkaloids; Alkaloids (Others); Biochemistry; Functional Products; Heterocycles; Intermediates & Fine Chemicals; Pharmaceuticals; API's; Acetylcholine receptor. As to its usage, it is usually applied as a selective acetylcholinesterase inhibitor.
The characteristics of this chemical are as below: (1)ACD/LogP: 1.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.59; (4)ACD/LogD (pH 7.4): 1.12; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2.94; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 49.83; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 30.93; (13)Flash Point: 219.5 °C; (14)Enthalpy of Vaporization: 73.39 kJ/mol; (15)Boiling Point: 439.3 °C at 760 mmHg; (16)Vapour Pressure: 1.71E-08 mmHg at 25°C; (17)Exact Mass: 367.078306; (18)MonoIsotopic Mass: 367.078306; (19)Topological Polar Surface Area: 41.9; (20)Heavy Atom Count: 22; (21)Complexity: 440.
When you are dealing with this chemical, you should be cautious. For being a kind of toxic chemical, it may at low levels cause damage to health and it will be very dangerous if swallowed. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. Then do not breathe dust, and if in case of accident or if you feel unwell, seek medical advice immediately (show the label where possible).
Additionally, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CN1CCC23C=CC(CC2OC4=C(C=CC(=C34)C1)OC)O.Br
(2)Isomeric SMILES: CN1CC[C@@]23C=C[C@@H](C[C@@H]2OC4=C(C=CC(=C34)C1)OC)O.Br
(3)InChI: InChI=1S/C17H21NO3.BrH/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17;/h3-6,12,14,19H,7-10H2,1-2H3;1H/t12-,14-,17-;/m0./s1
(4)InChIKey: QORVDGQLPPAFRS-XPSHAMGMSA-N