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6-Amino-7-Hydroxy-3,3-Dimethyl-8-Thioxo-3,4,7,8-Tetrahydro-1H-Pyrano[3,4-c]Pyridine-5-Carbonitrile
[CAS# 371780-31-3]

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Identification
Name 6-Amino-7-Hydroxy-3,3-Dimethyl-8-Thioxo-3,4,7,8-Tetrahydro-1H-Pyrano[3,4-c]Pyridine-5-Carbonitrile
Synonyms ZINC00495398
Molecular Structure CAS#: 371780-31-3, 6-Amino-7-Hydroxy-3,3-Dimethyl-8-Thioxo-3,4,7,8-Tetrahydro-1H-Pyrano[3,4-c]Pyridine-5-Carbonitrile
Molecular Formula C11H13N3O2S
Molecular Weight 251.30
CAS Registry Number 371780-31-3
SMILES S=C1\C2=C(/C(/C#N)=C(\N1O)N)CC(OC2)(C)C
InChI 1S/C11H13N3O2S/c1-11(2)3-6-7(4-12)9(13)14(15)10(17)8(6)5-16-11/h15H,3,5,13H2,1-2H3
InChIKey BHHJQZIRNFJENH-UHFFFAOYSA-N
Properties
Density 1.457g/cm3 (Cal.)
Boiling point 485.154°C at 760 mmHg (Cal.)
Flash point 247.213°C (Cal.)
Refractive index 1.686 (Cal.)
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