3-[(3S)-3-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propanenitrile
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![3-[(3S)-3-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propanenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/719c4ceab1a147ff86928853fc040672.png "3-[(3S)-3-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propanenitrile")
3-[(3S)-3-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propanenitrile
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CAS No:
41958-63-8
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Formula:
C19H20N2
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Chemical Name:
3-[(3S)-3-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propanenitrile
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Synonyms:
41958-63-8;BRN 1387494;trans-3-Methyl-4-phenyl-3,4-dihydro-2(1H)-isoquinolinepropionitrile;2(1H)-ISOQUINOLINEPROPIONITRILE, 3,4-DIHYDRO-3-METHYL-4-PHENYL-, (E)-;DTXSID80962112;3-(3-Methyl-4-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)propanenitrile
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CAS No:
3-[(3S)-3-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propanenitrile Basic Attributes
276.4 g/mol
276.162648646 g/mol
Computed Properties
Molecular Weight:276.4
XLogP3:3.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:276.162648646
Monoisotopic Mass:276.162648646
Topological Polar Surface Area:27
Heavy Atom Count:21
Complexity:376
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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