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Home >> Chemical Listing >> Page 1960 >> 3-(4-Pyridinyl)-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine

3-(4-Pyridinyl)-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine
[CAS# 602269-09-0]

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Identification
Name 3-(4-Pyridinyl)-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine
Synonyms 3-(pyridin-4-yl)-6,7,8,8a-tetrahydro-5H-isoxazolo[5,4-b]azepine
Molecular Structure CAS#: 602269-09-0, 3-(4-Pyridinyl)-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine
Molecular Formula C12H13N3O
Molecular Weight 215.25
CAS Registry Number 602269-09-0
SMILES c1cnccc1C2=NOC3C2=CCCCN3
InChI 1S/C12H13N3O/c1-2-6-14-12-10(3-1)11(15-16-12)9-4-7-13-8-5-9/h3-5,7-8,12,14H,1-2,6H2
InChIKey HKIKRMXDEHPFRV-UHFFFAOYSA-N
Properties
Density 1.338g/cm3 (Cal.)
Boiling point 389.953°C at 760 mmHg (Cal.)
Flash point 189.637°C (Cal.)
Refractive index 1.679 (Cal.)
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