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penphenone

penphenone structure

penphenone 

structure
  • CAS No:

    148-19-6

  • Formula:

    C12H16O3

  • Chemical Name:

    penphenone

  • Synonyms:

    2-phenyl-3-methyl-3-hydroxypentanoic acid;3-methyl-2-phenyl-3-hydroxypentanoic acid;penfenon;penphenone;penphenone, sodium salt;3-hydroxy-3-methyl-2-phenylpentanoic acid

penphenone Basic Attributes

208.25364

208.11

2918199090

Characteristics

57.5

2.2

1.149g/cm3

344.3ºC at 760mmHg

176.2ºC

1.546

2.54E-05mmHg at 25°C

Drug Information

2-phenyl-3-methyl-3-hydroxypentanoic acid

Computed Properties

Molecular Weight:208.25
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:208.109944368
Monoisotopic Mass:208.109944368
Topological Polar Surface Area:57.5
Heavy Atom Count:15
Complexity:221
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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