Thiiranepropanenitrile, beta-hydroxy-, (R*,S*)- structure

Thiiranepropanenitrile, beta-hydroxy-, (R*,S*)-

(3R)-3-hydroxy-3-[(2S)-thiiran-2-yl]propanenitrile

Also Known As: KST-1A5906|threo-4,5-Epithio-3-hydroxyvaleronitrile|Thiiranepropanenitrile, beta-hydroxy-, (R*,S*)-|threo-1-Cyano-2-hydroxy-3,4-epithiobutane|(2S)-1-Cyano-2-hydroxy-3,4-epithiobutane|Valeronitrile, 4,5-epithio-3-hydroxy-, threo-|4,5-Epithio-3-hydroxyvaleronitrile, stereoisomer|Valeronitrile, 4,5-epithio-3-hydroxy-, (3R,4S)-|Valeronitrile, 4,5-epithio-3-hydroxy-, stereoisomer|5-18-07-00243 (Beilstein Handbook Reference)|(3R)-3-hydroxy-3-((2S)-thiiran-2-yl)propanenitrile|(3R)-3-hydroxy-3-[(2S)-thiiran-2-yl]propanenitrile|(3r)-3-hydroxy-3-[(2s)-thiiran-2-yl]propanenitrile(non-preferred name)

CAS: 5463-26-3
Molecular Formula C5H7NOS
Molecular Weight 129.02484 g/mol
LogP -0.2
Topological Polar Surface Area 69.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 129.02484
Monoisotopic Mass 129.02484
Heavy Atoms 8
Complexity 128.0

Chemical Identifiers

CAS Number 5463-26-3
SMILES C1[C@@H](S1)[C@@H](CC#N)O
InChIKey YHHMEZJFUCZIOV-RFZPGFLSSA-N

Product Overview

Thiiranepropanenitrile, beta-hydroxy-, (R*,S*)- (CAS 5463-26-3), with molecular formula C5H7NOS and molecular weight 129.02484 g/mol. IUPAC: (3R)-3-hydroxy-3-[(2S)-thiiran-2-yl]propanenitrile.

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