Cas no 64201-30-5 (Methyl 5-(4-hydroxyphenyl)pentanoate)

Methyl 5-(4-hydroxyphenyl)pentanoate structure
64201-30-5 structure
Product Name:Methyl 5-(4-hydroxyphenyl)pentanoate
CAS No:64201-30-5
MF:C12H16O3
MW:208.253643989563
CID:1084042
PubChem ID:12403779
Update Time:2025-04-20

Methyl 5-(4-hydroxyphenyl)pentanoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 5-(4-hydroxyphenyl)pentanoate
    • DB-352059
    • SCHEMBL2158877
    • Benzenepentanoic acid, 4-hydroxy-, methyl ester
    • 64201-30-5
    • VRPBPRWMUAQEJY-UHFFFAOYSA-N
    • MDL: MFCD21604139
    • Inchi: 1S/C12H16O3/c1-15-12(14)5-3-2-4-10-6-8-11(13)9-7-10/h6-9,13H,2-5H2,1H3
    • InChI Key: VRPBPRWMUAQEJY-UHFFFAOYSA-N
    • SMILES: O(C)C(CCCCC1C=CC(=CC=1)O)=O

Computed Properties

  • Exact Mass: 208.109944368g/mol
  • Monoisotopic Mass: 208.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 6
  • Complexity: 183
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.5
  • Topological Polar Surface Area: 46.5?2
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