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3,3a,4,5,6,6alpha-Hexahydro-2H-Pentalen-1-One
[CAS# 29365-79-5]
Identification
| Name |
3,3a,4,5,6,6alpha-Hexahydro-2H-Pentalen-1-One |
| Synonyms |
Trans-Bicyclo(3.3.0)-Octan-2-One; Cis-Bicyclo(3.3.0)-Octan-2-One; Trans-Bicyclo[3.3.0]-Octan-2-One |
|
| Molecular Structure |
 |
| Molecular Formula |
C8H12O |
| Molecular Weight |
124.18 |
| CAS Registry Number |
29365-79-5 |
| SMILES |
O=C1C2C(CC1)CCC2 |
| InChI |
1S/C8H12O/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5H2 |
| InChIKey |
NZTVVUIIJPWANB-UHFFFAOYSA-N |
|
Properties
| Density |
1.04g/cm3 (Cal.) |
| Boiling point |
201.624°C at 760 mmHg (Cal.) |
| Flash point |
68.658°C (Cal.) |
|
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