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Jacaranone

Jacaranone structure

Jacaranone 

structure
  • CAS No:

    60263-07-2

  • Formula:

    C9H10O4

  • Chemical Name:

    Jacaranone

  • Synonyms:

    2,5-Cyclohexadiene-1-acetic acid,1-hydroxy-4-oxo-,methyl ester;Jacaranone;Jacaranon;NSC 251682;NSC 289076

Jacaranone Basic Attributes

182.17 g/mol

182.17

289076|251682

Characteristics

63.6 Ų

53-54 °C

Drug Information

jacaranone

Computed Properties

Molecular Weight:182.17
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:182.05790880
Monoisotopic Mass:182.05790880
Topological Polar Surface Area:63.6
Heavy Atom Count:13
Complexity:272
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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