(E)-but-2-enedioic acid,1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]propan-1-one
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![(E)-but-2-enedioic acid,1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]propan-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b796fac72f3548fd9ec1317442f846f4.png "(E)-but-2-enedioic acid,1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]propan-1-one")
(E)-but-2-enedioic acid,1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]propan-1-one
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CAS No:
152271-02-8
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Formula:
C42H66N2O12
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Chemical Name:
(E)-but-2-enedioic acid,1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]propan-1-one
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Synonyms:
1-Propanone,1-(4-(2-hydroxy-3-(propylamino)propoxy)-3-(propoxymethyl)phenyl)-,(E)-2-butenedioate (2:1) (salt);
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CAS No:
(E)-but-2-enedioic acid,1-[4-[2-hydroxy-3-(propylamino)propoxy]-3-(propoxymethyl)phenyl]propan-1-one Basic Attributes
790.98000
790.46157554
Computed Properties
Molecular Weight:791.0
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:28
Exact Mass:790.46157554
Monoisotopic Mass:790.46157554
Topological Polar Surface Area:210
Heavy Atom Count:56
Complexity:456
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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