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(3aS,7aS)-(+)-Hexahydro-3alpha-Hydroxy-7alpha-Methyl-1,5-Indandione
[CAS# 33879-04-8]

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Identification
Name (3aS,7aS)-(+)-Hexahydro-3alpha-Hydroxy-7alpha-Methyl-1,5-Indandione
Synonyms (3As,7As)-3A-Hydroxy-7A-Methyl-3,4,6,7-Tetrahydro-2H-Indene-1,5-Quinone; 297933_Aldrich; Zinc04026321
Molecular Structure CAS#: 33879-04-8, (3aS,7aS)-(+)-Hexahydro-3alpha-Hydroxy-7alpha-Methyl-1,5-Indandione
Molecular Formula C10H14O3
Molecular Weight 182.22
CAS Registry Number 33879-04-8
SMILES [C@]12([C@@](C(=O)CC1)(CCC(C2)=O)C)O
InChI 1S/C10H14O3/c1-9-4-2-7(11)6-10(9,13)5-3-8(9)12/h13H,2-6H2,1H3/t9-,10+/m1/s1
InChIKey PUHCDQVSBDIJTM-ZJUUUORDSA-N
Properties
Density 1.3g/cm3 (Cal.)
Boiling point 328.918°C at 760 mmHg (Cal.)
Flash point 166.933°C (Cal.)
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