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(3R,4S)-3,4-Dimethylcyclopentanone
[CAS# 19550-72-2]

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Identification
Name (3R,4S)-3,4-Dimethylcyclopentanone
Synonyms Cis-3,4-dimethyl cyclopentanone; CIS-3,4-DIMETHYLCYCLOPENTANONE
Molecular Structure CAS#: 19550-72-2, (3R,4S)-3,4-Dimethylcyclopentanone
Molecular Formula C7H12O
Molecular Weight 112.17
CAS Registry Number 19550-72-2
SMILES O=C1C[C@@H](C)[C@@H](C)C1
InChI 1S/C7H12O/c1-5-3-7(8)4-6(5)2/h5-6H,3-4H2,1-2H3/t5-,6+
InChIKey ZMGMYCHEWPVBEL-OLQVQODUSA-N
Properties
Density 0.896g/cm3 (Cal.)
Boiling point 154.822°C at 760 mmHg (Cal.)
Flash point 40.6°C (Cal.)
Refractive index 1.434 (Cal.)
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