Identification and Related Records
- 【CAS Registry number】
- 93793-83-0
- 【Synonyms】
-
Altat (TN)
Roxatidine acetate hydrochloride (JAN/USAN)
Acetamide,2-(acetyloxy)-N-[3-[3-(1- piperidinylmethyl)phenoxy]propyl]-,monohydrochloride
Altat
Roxatidine aceacetate HCl
Acetamide,2-(acetyloxy)-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-monohydrochloride
Roxatidine Acetate HCl
- 【Molecular Formula】
- C19H28N2O4.ClH (Products with the same molecular formula)
- 【Inchi】
- InChI=1/C19H28N2O4.ClH/c1-16(22)25-15-19(23)20-9-6-12-24-18-8-5-7-17(13-18)14-21-10-3-2-4-11-21;/h5,7-8,13H,2-4,6,9-12,14-15H2,1H3,(H,20,23);1H
93793-83-0.mol
Chemical and Physical Properties
- 【Computed Properties】
- Molecular Weight:384.89756 [g/mol]
Molecular Formula:C19H29ClN2O4
H-Bond Donor:2
H-Bond Acceptor:5
Rotatable Bond Count:10
Tautomer Count:2
Exact Mass:384.181585
MonoIsotopic Mass:384.181585
Topological Polar Surface Area:67.9
Heavy Atom Count:26
Formal Charge:0
Complexity:410
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2
Safety and Handling
- 【Safety】
-
Poison by ingestion, subcutaneous, intravenous, and intraperitoneal routes. An experimental teratogen. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx and HCl. See also ESTERS.
- 【Specification】
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?Roxatidine acetate hydrochloride (CAS NO.111470-99-6), its Synonyms are 2-Acetoxy-N-(3-(m-(1-piperidinylmethyl)phenoxy)propyl)acetamide hydrochloride ; 2-Hydroxy-N-(3-(m-(piperidinomethyl)phenoxy)propyl)acetamide acetate (ester) hydrochloride ; Aceroxatidine hydrochloride ; Acetamide, 2-(acetyloxy)-N-(3-(3-(1-piperidinylmethyl)phenoxy)propyl)-, monohydrochloride ; N-(3-((alpha-Piperidino-m-tolyl)oxy)propyl)glycolamide acetate (ester), monohydrochloride .
China
skype