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Home >> Chemical Listing >> Page 781 >> 1-(1H-Purin-6-Yl)Ethanone

1-(1H-Purin-6-Yl)Ethanone
[CAS# 188049-34-5]

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Identification
Name 1-(1H-Purin-6-Yl)Ethanone
Synonyms 1-(1H-purin-6-yl)ethanone
Molecular Structure CAS#: 188049-34-5, 1-(1H-Purin-6-Yl)Ethanone
Molecular Formula C7H6N4O
Molecular Weight 162.15
CAS Registry Number 188049-34-5
SMILES CC(=O)c1ncnc2ncnc12
InChI 1S/C7H6N4O/c1-4(12)5-6-7(10-2-8-5)11-3-9-6/h2-3H,1H3,(H,8,9,10,11)
InChIKey QQYQCXTVSRSYGP-UHFFFAOYSA-N
Properties
Density 1.434g/cm3 (Cal.)
Boiling point 470.845°C at 760 mmHg (Cal.)
Flash point 236.99°C (Cal.)
Refractive index 1.682 (Cal.)
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