methyl (3S)-1-methyl-4-phenylpiperidin-1-ium-3-carboxylate;bromide
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methyl (3S)-1-methyl-4-phenylpiperidin-1-ium-3-carboxylate;bromide
structure -
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CAS No:
57152-96-2
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Formula:
C14H20BrNO2
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Chemical Name:
methyl (3S)-1-methyl-4-phenylpiperidin-1-ium-3-carboxylate;bromide
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Synonyms:
57152-96-2;NIPECOTIC ACID, 1-METHYL-4-PHENYL-, METHYL ESTER, HYDROBROMIDE, (E)-(+-)-;(+-)-trans-1-Methyl-4-phenylnipecotic acid methyl ester hydrobromide;trans-1-Methyl-4-phenyl-piperidin-3-carbonsaeure-methylester-hydrobromid [German];trans-1-Methyl-4-phenyl-piperidin-3-carbonsaeure-methylester-hydrobromid
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CAS No:
methyl (3S)-1-methyl-4-phenylpiperidin-1-ium-3-carboxylate;bromide Basic Attributes
314.22 g/mol
313.06774 g/mol
Computed Properties
Molecular Weight:314.22
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:313.06774
Monoisotopic Mass:313.06774
Topological Polar Surface Area:30.7
Heavy Atom Count:18
Complexity:261
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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