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Isopropyl ferulate

Isopropyl ferulate structure

Isopropyl ferulate 

structure
  • CAS No:

    59831-94-6

  • Formula:

    C13H16O4

  • Chemical Name:

    Isopropyl ferulate

  • Synonyms:

    2-Propenoic acid,3-(4-hydroxy-3-methoxyphenyl)-,1-methylethyl ester;Cinnamic acid,4-hydroxy-3-methoxy-,isopropyl ester;Isopropyl ferulate

Isopropyl ferulate Basic Attributes

236.26400

236.26

2918990090

Characteristics

55.76000

2.36560

1.145g/cm3

358.2ºC at 760mmHg

131.9ºC

1.556

Computed Properties

Molecular Weight:236.26
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:236.10485899
Monoisotopic Mass:236.10485899
Topological Polar Surface Area:55.8
Heavy Atom Count:17
Complexity:273
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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