(2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-6-yl) 3,4,5-trimethoxybenzoate,chloride
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(2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-6-yl) 3,4,5-trimethoxybenzoate,chloride
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CAS No:
57464-37-6
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Formula:
C20H30ClNO5
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Chemical Name:
(2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-6-yl) 3,4,5-trimethoxybenzoate,chloride
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Synonyms:
trans-Decahydro-2-methyl-6-isoquinolinol 3,4,5-trimethoxybenzoate hydrochloride; Benzoic acid,3,4,5-trimethoxy-,decahydro-2-methylisoquinolin-6-yl ester,HCl,trans;
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CAS No:
(2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-2-ium-6-yl) 3,4,5-trimethoxybenzoate,chloride Basic Attributes
399.90900
399.1812508 g/mol
Computed Properties
Molecular Weight:399.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:399.1812508
Monoisotopic Mass:399.1812508
Topological Polar Surface Area:58.4
Heavy Atom Count:27
Complexity:459
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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