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Abscisicacidmethylester

Abscisicacidmethylester structure

Abscisicacidmethylester 

structure
  • CAS No:

    7200-31-9

  • Formula:

    C16H22O4

  • Chemical Name:

    Abscisicacidmethylester

  • Synonyms:

    (2Z,4E)-Methyl abscisate;DTXSID301019235;Methyl (2E,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-3-methyl-2,4-pentadienoate #;ZINC33846667;(2Z,4E)-5-[(R)-1-Hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl]-3-methyl-2,4-pentadienoic acid methyl ester;5-[(1R)-2,6,6-Trimethyl-4-oxo-1-hydroxy-2-cyclohexenyl]-3-methyl-2,4-pentadienoic acid methyl ester

Abscisicacidmethylester Basic Attributes

278.348

278.152

Characteristics

63.6

1.9

Computed Properties

Molecular Weight:278.34
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:278.15180918
Monoisotopic Mass:278.15180918
Topological Polar Surface Area:63.6
Heavy Atom Count:20
Complexity:509
Defined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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