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Tropisetron monohydrochloride(CAS No. 105826-92-4)

Tropisetron monohydrochloride C17H20N2O2.HCl (cas 105826-92-4) Molecular Structure

105826-92-4 Structure

Identification and Related Records

【Name】
Tropisetron monohydrochloride
【CAS Registry number】
105826-92-4
【Synonyms】
1H-Indole-3-carboxylicacid, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, monohydrochloride(9CI)
1H-Indole-3-carboxylic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester,monohydrochloride, endo-
Novaban
Tropisetron hydrochloride
Tropisetron HCl
【Molecular Formula】
C17H20N2O2.HCl (Products with the same molecular formula)
【Molecular Weight】
320.81
【Inchi】
InChI=1/C17H20N2O2.ClH/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16;/h2-5,10-13,18H,6-9H2,1H3;1H
【Canonical SMILES】
CN1C2CCC1CC(C2)OC(=O)C3=CNC4=CC=CC=C43.Cl
【Isomers smiles】
CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C3=CNC4=CC=CC=C43.Cl
【MOL File】
105826-92-4.mol

Chemical and Physical Properties

【Melting Point】
283-285℃
【Boiling Point】
448.5 oC at 760 mmHg
【Vapour】
3.09E-08mmHg at 25°C
【Flash Point】
225 oC
【Storage temp】
2-8°C
【Computed Properties】
Molecular Weight:320.81384 [g/mol]
Molecular Formula:C17H21ClN2O2
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:3
Tautomer Count:3
Exact Mass:320.129156
MonoIsotopic Mass:320.129156
Topological Polar Surface Area:45.3
Heavy Atom Count:22
Formal Charge:0
Complexity:400
Isotope Atom Count:0
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2

Safety and Handling

【Specification】

?Tropisetron monohydrochloride (CAS NO.105826-92-4), its Synonyms are Tropisetron HCl ; 1H-Indole-3-carboxylic acid, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, monohydrochloride, endo- ; 1H-Indole-3-carboxylic acid, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, hydrochloride (1:1) ; 1H-Indole-3-carboxylic acid (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester hydrochloride . It is white to off-white crystalline solid.

Use and Manufacturing

【Usage】

Specific serotonin (5-HT3) receptor antagonist. Antiemetic.

Biomedical Effects and Toxicity

【Biological Activity】
Potent, orally active 5-HT 3 receptor antagonist. Antiemetic.
【Pharmacological Action】
- Drugs used to prevent NAUSEA or VOMITING.
- Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS.

Supplier Location

Top Suppliers

Diamond member Wuhan Fortuna Chemical Co., Ltd.
Country:ChinaChina
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Diamond member Hangzhou Dayangchem Co., Ltd.
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Business Type:Trading Company
Telephone:86-312-18103315327
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Diamond member AOPHARM
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Diamond member Jinlan Pharm-Drugs Technology Co., Limited
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Telephone:86-571-85829152
Diamond member Hangzhou J&H Chemical Co., Ltd
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Telephone:86-571-87396430
Hui Chem Company Limited
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-21-60542966

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