2-hydroxypropane-1,2,3-tricarboxylic acid;3-(1-methyl-3-propylpyrrolidin-3-yl)phenol
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2-hydroxypropane-1,2,3-tricarboxylic acid;3-(1-methyl-3-propylpyrrolidin-3-yl)phenol
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CAS No:
64047-77-4
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Formula:
C20H29NO8
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Chemical Name:
2-hydroxypropane-1,2,3-tricarboxylic acid;3-(1-methyl-3-propylpyrrolidin-3-yl)phenol
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Synonyms:
64047-77-4;3-(1-Methyl-3-propyl-3-pyrrolidinyl)phenol citrate;Profadol citrate;Phenol, 3-(1-methyl-3-propyl-3-pyrrolidinyl)-, citrate;Pyrrolidine, 3-(5-hydroxyphenyl)-1-methyl-3-propyl-, citrate;DTXSID10982247;2-Hydroxypropane-1,2,3-tricarboxylic acid--3-(1-methyl-3-propylpyrrolidin-3-yl)phenol (1/1)
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CAS No:
2-hydroxypropane-1,2,3-tricarboxylic acid;3-(1-methyl-3-propylpyrrolidin-3-yl)phenol Basic Attributes
411.4 g/mol
411.18931688 g/mol
Computed Properties
Molecular Weight:411.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:411.18931688
Monoisotopic Mass:411.18931688
Topological Polar Surface Area:156
Heavy Atom Count:29
Complexity:458
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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