Cas no 197307-49-6 (b-D-Glucopyranoside, 3-hydroxy-5-pentylphenyl)

b-D-Glucopyranoside, 3-hydroxy-5-pentylphenyl structure
197307-49-6 structure
Product Name:b-D-Glucopyranoside, 3-hydroxy-5-pentylphenyl
CAS No:197307-49-6
MF:C17H26O7
MW:342.384146213531
CID:841113
PubChem ID:91885017
Update Time:2025-09-27

b-D-Glucopyranoside, 3-hydroxy-5-pentylphenyl Chemical and Physical Properties

Names and Identifiers

    • b-D-Glucopyranoside, 3-hydroxy-5-pentylphenyl
    • 11-Dehydroxygrevilloside B
    • 3-Hydroxy-5-pentylphenyl β-D-glucopyranoside
    • 3-Hydroxy-5-pentylphenyl Beta-D-glucopyranoside
    • 3-Hydroxy-5-pentylphenyl-beta-D-glucopyranoside
    • [ "" ]
    • DA-69971
    • (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(3-hydroxy-5-pentylphenoxy)oxane-3,4,5-triol
    • HY-N9077
    • (2S,3R,4S,5S,6R)-2-(3-HYDROXY-5-PENTYLPHENOXY)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL
    • FS-9518
    • 197307-49-6
    • GLXC-16974
    • CS-0158659
    • AKOS032961743
    • Inchi: 1S/C17H26O7/c1-2-3-4-5-10-6-11(19)8-12(7-10)23-17-16(22)15(21)14(20)13(9-18)24-17/h6-8,13-22H,2-5,9H2,1H3/t13-,14-,15+,16-,17-/m1/s1
    • InChI Key: MWVXDTUYXNKDPO-NQNKBUKLSA-N
    • SMILES: O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)OC1=CC(=CC(=C1)CCCCC)O

Computed Properties

  • Exact Mass: 342.16800
  • Monoisotopic Mass: 342.16785316g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 7
  • Complexity: 367
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 120?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 587.3±50.0 °C at 760 mmHg
  • Flash Point: 309.0±30.1 °C
  • PSA: 119.61000
  • LogP: 0.30360
  • Vapor Pressure: 0.0±1.7 mmHg at 25°C

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