Cas no 7473-41-8 ((3,5-dibenzoyloxy-4-hydroxyoxolan-2-yl)methyl Benzoate)

(3,5-dibenzoyloxy-4-hydroxyoxolan-2-yl)methyl Benzoate structure
7473-41-8 structure
Product Name:(3,5-dibenzoyloxy-4-hydroxyoxolan-2-yl)methyl Benzoate
CAS No:7473-41-8
MF:C26H22O8
MW:462.448088169098
CID:980117
PubChem ID:343784
Update Time:2025-04-19

(3,5-dibenzoyloxy-4-hydroxyoxolan-2-yl)methyl Benzoate Chemical and Physical Properties

Names and Identifiers

    • (3,5-dibenzoyloxy-4-hydroxyoxolan-2-yl)methyl Benzoate
    • 1,3,4,6-Tetra-O-acetylhexopyranose
    • AC1L7PL0
    • ACMC-209esu
    • AGN-PC-00NI09
    • Ambcb5136342
    • HMS1577D04
    • NSC231870
    • 1,3,5-Tr-O_ibenzoyl-.beta.-arabinose
    • NSC400280
    • SY127608
    • DTXSID40996256
    • [4-oxidanyl-3,5-bis(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate
    • SY047754
    • A816025
    • 1,3,5-Tri-O-benzoylpentofuranose #
    • [(2S,3R,4S,5S)-3,5-bis(benzoyloxy)-4-hydroxyoxolan-2-yl]methyl benzoate
    • HUHVPBKTTFVAQF-UHFFFAOYSA-N
    • NSC-400280
    • FT-0638200
    • SCHEMBL13146095
    • 7473-41-8
    • MFCD19981135
    • 1,3,5-Tri-O-benzoylpentofuranose
    • 5-[(Benzoyloxy)methyl]-3-hydroxytetrahydrofuran-2,4-diyl (3R,4S,5R)-Dibenzoate
    • MFCD00080818
    • 314289-48-0
    • benzoic acid (3,5-dibenzoyloxy-4-hydroxy-2-oxolanyl)methyl ester
    • Inchi: 1S/C26H22O8/c27-21-22(33-24(29)18-12-6-2-7-13-18)20(16-31-23(28)17-10-4-1-5-11-17)32-26(21)34-25(30)19-14-8-3-9-15-19/h1-15,20-22,26-27H,16H2
    • InChI Key: HUHVPBKTTFVAQF-UHFFFAOYSA-N
    • SMILES: O1C(C(C(C1COC(C1C=CC=CC=1)=O)OC(C1C=CC=CC=1)=O)O)OC(C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 462.13146
  • Monoisotopic Mass: 462.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 10
  • Complexity: 691
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.2
  • Topological Polar Surface Area: 108?2

Experimental Properties

  • Density: 1.37
  • Boiling Point: 629.6°C at 760 mmHg
  • Flash Point: 213°C
  • Refractive Index: 1.633
  • PSA: 108.36
  • LogP: 3.01180
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