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Thymolphthalein monophosphate

Thymolphthalein monophosphate structure

Thymolphthalein monophosphate 

structure
  • CAS No:

    17016-43-2

  • Formula:

    C28H31O7P

  • Chemical Name:

    Thymolphthalein monophosphate

  • Synonyms:

    1(3H)-Isobenzofuranone,3-[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-;Phenolphthalein,5′,5′′-diisopropyl-2′,2′′-dimethyl-,mono(dihydrogen phosphate);3-[4-Hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-1(3H)-isobenzofuranone;Thymolphthalein monophosphate

Thymolphthalein monophosphate Basic Attributes

510.5 g/mol

510.52

241-090-3

Characteristics

113 Ų

Drug Information

thymolphthalein monophosphate

Thymolphthalein monophosphate Use and Manufacturing

1(3H)-Isobenzofuranone, 3-[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-: INACTIVE

Computed Properties

Molecular Weight:510.5
XLogP3:5.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:510.18074032
Monoisotopic Mass:510.18074032
Topological Polar Surface Area:113
Heavy Atom Count:36
Complexity:840
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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