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Home > Encyclopedia > 1-Phenyl-2,4-pentanedione

1-Phenyl-2,4-pentanedione

1-Phenyl-2,4-pentanedione structure

1-Phenyl-2,4-pentanedione 

structure
  • CAS No:

    3318-61-4

  • Formula:

    C11H12O2

  • Chemical Name:

    1-Phenyl-2,4-pentanedione

  • Synonyms:

    2,4-Pentanedione,1-phenyl-;1-Phenyl-2,4-pentanedione;1-Benzyl-1,3-butanedione;(Phenylacetyl)acetone

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

1-Phenyl-2,4-pentanedione Basic Attributes

176.21200

176.21

222-015-3

DTXSID0062973

2914399090

Characteristics

34.14000

1.77730

1.061g/cm3

96-100 °C @ Press: 2.5 Torr

103.2ºC

1.511

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

1-Phenyl-2,4-pentanedione Use and Manufacturing

2,4-Pentanedione, 1-phenyl-: INACTIVE

Computed Properties

Molecular Weight:176.21
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:176.083729621
Monoisotopic Mass:176.083729621
Topological Polar Surface Area:34.1
Heavy Atom Count:13
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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