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2-Hexanone-1,1,1,3,3-D5
[CAS# 4840-82-8]

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Identification
Name 2-Hexanone-1,1,1,3,3-D5
Synonyms 2-Hexanone, 1,1,1,3,3-D5-
Molecular Structure CAS#: 4840-82-8, 2-Hexanone-1,1,1,3,3-D5
Molecular Formula C6H7D5O
Molecular Weight 105.19
CAS Registry Number 4840-82-8
SMILES C(C(=O)C([2H])([2H])[2H])([2H])([2H])CCC
InChI 1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3/i2D3,5D2
InChIKey QQZOPKMRPOGIEB-ZTIZGVCASA-N
Properties
Density 0.844g/cm3 (Cal.)
Boiling point 127.775°C at 760 mmHg (Cal.)
Flash point 35°C (Cal.)
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