2-hydroxy-2-oxoacetate;[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-pyrrolidin-1-ium-1-ylethyl)azanium
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![2-hydroxy-2-oxoacetate;[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-pyrrolidin-1-ium-1-ylethyl)azanium structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/52ba02765e5540b6a09d6e3cd844a1dd.png "2-hydroxy-2-oxoacetate;[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-pyrrolidin-1-ium-1-ylethyl)azanium")
2-hydroxy-2-oxoacetate;[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-pyrrolidin-1-ium-1-ylethyl)azanium
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CAS No:
10537-02-7
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Formula:
C28H38N2O9
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Chemical Name:
2-hydroxy-2-oxoacetate;[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-pyrrolidin-1-ium-1-ylethyl)azanium
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Synonyms:
10537-02-7;2-Furanpropylamine, tetrahydro-beta-(1-naphthylmethyl)-N-(2-pyrrolidinoethyl)-, bioxalate;N-(2-Pyrrolidinoethyl)-beta-tetrahydrofurfuryl-1-naphthalenepropylamine bioxalate;1-Naphthalenepropylamine, N-(2-pyrrolidinoethyl)-beta-(tetrahydrofurfuryl)-, bioxalate
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CAS No:
2-hydroxy-2-oxoacetate;[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-pyrrolidin-1-ium-1-ylethyl)azanium Basic Attributes
546.6 g/mol
546.25773079 g/mol
Computed Properties
Molecular Weight:546.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:546.25773079
Monoisotopic Mass:546.25773079
Topological Polar Surface Area:185
Heavy Atom Count:39
Complexity:501
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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