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2,4,6-cycloheptatrien-1-one

Molecular Formula:

C7H6O

Molecular Weight:

106.124 g/mol

Registry Numbers

Cas Number: 539-80-0

EINECS Number: 208-725-6

MDL Number: MFCD00014331

InChIKey:

QVWDCTQRORVHHT-UHFFFAOYAM

Smiles:

O=C1C=CC=CC=C1

Chemical structure of 2,4,6-cycloheptatrien-1-one

Synthesis Reference(s)

Journal of the American Chemical Society, 78, p. 5442, 1956 DOI: 10.1021/ja01601a077
The Journal of Organic Chemistry, 29, p. 960, 1964
Organic Syntheses, Coll. Vol. 9, p. 396, 1998

Synonym Chemical Name(s)

cyclohepta-2,4,6-trien-1-one
cyclohepta-2,4,6-trien-1-on
シクロヘプタ-2,4,6-トリエン-1-オン

Physical Properties

Melting Point: n/a
Boiling Point: 91-92 ºC (4 mmHg)

Density: 1.094 g/mL
Refractive Index: 1.6150

MSDS:

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