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CAS Number: 111511-90-1
dihydro-2H-pyran-4,4(3H)-dicarbonitrile

Structure

dihydro-2H-pyran-4,4(3H)-dicarbonitrile
Name: dihydro-2H-pyran-4,4(3H)-dicarbonitrile
Synonyms:
General Information
Product Number: 111511901
CAS Registry Number:
111511-90-1
Name:
4H-Pyran-4,4-dicarbonitrile, tetrahydro-
Dihydro-2H-pyran-4,4(3H)-dicarbonitrile; Tetrahydropyran-4,4-dicarbonitrile 
 
Chemical Formula: C7H8N2O
Exact Mass: 136.06
Molecular Weight: 136.15
m/z: 136.06 (100.0%), 137.07 (7.7%)
Elemental Analysis: C, 61.75; H, 5.92; N, 20.58; O, 11.75
 
InChI: InChI=1S/C7H8N2O/c8-5-7(6-9)1-3-10-4-2-7/h1-4H2
InChIKey: BZWZQQPETNQTFG-UHFFFAOYSA-N
Canonical SMILES : C1COCCC1(C#N)C#N
 
 
Thermal Properties Value Condition Note
Melting Point 113-114 °C Solv: ethanol (64-17-5) (1)IC

Specification

98%

References
  1. (1) Bitha, Panayota; Journal of Medicinal Chemistry 1989, V32(8), P2015-20 CAPLUS
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