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Home >> Chemical Listing >> Page 2779 >> 1-[(1R,4S,5r)-Bicyclo[2.1.1]hex-5-yl]ethanone

1-[(1R,4S,5r)-Bicyclo[2.1.1]hex-5-yl]ethanone
[CAS# 85439-92-5]

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Identification
Name 1-[(1R,4S,5r)-Bicyclo[2.1.1]hex-5-yl]ethanone
Synonyms 1-((1R,4S,5r)-bicyclo[2.1.1]hexan-5-yl)ethanone
Molecular Structure CAS#: 85439-92-5, 1-[(1R,4S,5r)-Bicyclo[2.1.1]hex-5-yl]ethanone
Molecular Formula C8H12O
Molecular Weight 124.18
CAS Registry Number 85439-92-5
SMILES CC(=O)[C@H]1[C@@H]2CC[C@H]1C2
InChI 1S/C8H12O/c1-5(9)8-6-2-3-7(8)4-6/h6-8H,2-4H2,1H3/t6-,7+,8+
InChIKey LHSXSEWPRHIMRB-JIGDXULJSA-N
Properties
Density 1.046g/cm3 (Cal.)
Boiling point 188.238°C at 760 mmHg (Cal.)
Flash point 59.192°C (Cal.)
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