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1 Kilogram |
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8-Azabicyclo[3.2.1]octan-3-ol,8-methyl-, 3-benzoate, hydrochloride (1:1), (3-endo)- 55623-27-3 98%
【Name】
8-Azabicyclo[3.2.1]octan-3-ol,8-methyl-, 3-benzoate, hydrochloride (1:1), (3-endo)-
【CAS Registry number】
55623-27-3
【Synonyms】
8-Azabicyclo[3.2.1]octan-3-ol,8-methyl-, benzoate (ester), hydrochloride, (3-endo)- (9CI)
8-Azabicyclo[3.2.1]octan-3-ol, 8-methyl-, benzoate (ester), hydrochloride,endo-
NSC 94260
Tropine benzoate hydrochloride
【Molecular Formula】
C15H19 N O2 . Cl H (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C15H19NO2.ClH/c1-16-12-7-8-13(16)10-14(9-12)18-15(17)11-5-3-2-4-6-11;/h2-6,12-14H,7-10H2,1H3;1H/t12-,13+,14+;
【Canonical SMILES】
CN1C2CCC1CC(C2)OC(=O)C3=CC=CC=C3.Cl
【MOL File】
55623-27-3.mol
Chemical and Physical Properties
【Density】
1.15g/cm3
【Boiling Point】
339.9°Cat760mmHg
【Flash Point】
122.3°C
【Computed Properties】
Molecular Weight:281.7778 [g/mol]
Molecular Formula:C15H20ClNO2
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:3
Exact Mass:281.118257
MonoIsotopic Mass:281.118257
Topological Polar Surface Area:29.5
Heavy Atom Count:19
Formal Charge:0
Complexity:298
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2
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