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Home > Encyclopedia > 3-[1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol

3-[1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol

3-[1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol structure

3-[1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol 

structure
  • CAS No:

    148589-31-5

  • Formula:

    C16H18N2O4

  • Chemical Name:

    3-[1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol

  • Synonyms:

    Caged-PE; 3-{1-hydroxy-2-[methyl(2-nitrobenzyl)amino]ethyl}phenol; Benzenemethanol,3-hydroxy-a-[[methyl[(2-nitrophenyl)methyl]amino]methyl]; N-2-Nitrobenzylphenylephrine; Caged phenylephrine;

  • Categories:

    Organic Chemistry  >  Amides

3-[1-hydroxy-2-[methyl-[(2-nitrophenyl)methyl]amino]ethyl]phenol Basic Attributes

302.32500

302.12665706 g/mol

Characteristics

89.52000

2.98900

1.304g/cm3

501ºC

256.8ºC

1.637

7.39E-11mmHg at 25°C

Drug Information

caged phenylephrine

Computed Properties

Molecular Weight:302.32
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:302.12665706
Monoisotopic Mass:302.12665706
Topological Polar Surface Area:89.5
Heavy Atom Count:22
Complexity:361
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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