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PBFIFREEACID

PBFIFREEACID structure

PBFIFREEACID 

structure
  • CAS No:

    124549-11-7

  • Formula:

    C46H46N2O16

  • Chemical Name:

    PBFIFREEACID

  • Synonyms:

    4-[6-[16-[2-(2,4-dicarboxyphenyl)-5-methoxy-1-benzofuran-6-yl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]-5-methoxy-1-benzofuran-2-yl]benzene-1,3-dicarboxylic acid;PBFI FREE ACID;pbfi;PBFI potassiuM fluorescence probe;1,4,10,13-tetraoxa-7,16-diazacyclooctadecane, 1,3-benzenedicarboxylic Acid Derivative;1,3-Benzenedicarboxylic acid, 4,4'-[1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7,16-diylbis(5-methoxy-6,2-benzofurandiyl)]bis-

PBFIFREEACID Basic Attributes

882.86

882.28473338

DTXSID60401216

Characteristics

1.344±0.06 g/cm3

>200℃

1058.8±65.0 °C(Predicted)

4.56±0.10

Drug Information

K+-binding benzofuran isophthalate

Computed Properties

Molecular Weight:882.9
XLogP3:5.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:10
Exact Mass:882.28473338
Monoisotopic Mass:882.28473338
Topological Polar Surface Area:237
Heavy Atom Count:64
Complexity:1410
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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