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5-Hexyn-2-one

5-Hexyn-2-one structure

5-Hexyn-2-one 

structure
  • CAS No:

    2550-28-9

  • Formula:

    C6H8O

  • Chemical Name:

    5-Hexyn-2-one

  • Synonyms:

    5-Hexyn-2-one;Propargyl acetone;1-Hexyn-5-one;5-Oxo-1-hexyne

  • Categories:

    Chemical Reagents  >  Organic Reagents

5-Hexyn-2-one Basic Attributes

96.12710

96.13

DTXSID50180189

2914190090

Characteristics

17.07000

0.98880

0.9065 g/cm3 @ Temp: 420 °C

149 °C

42.7ºC

1.424

3.95mmHg at 25°C

Safety Information

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:96.13
XLogP3:0.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:96.057514874
Monoisotopic Mass:96.057514874
Topological Polar Surface Area:17.1
Heavy Atom Count:7
Complexity:105
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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