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Home > Encyclopedia > 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid

2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid

pharmaceutical raw materials
2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid structure

2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid 

structure
  • CAS No:

    96989-76-3

  • Formula:

    C22H28Br2N6O5

  • Chemical Name:

    2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid

  • Synonyms:

    2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid;4-[(2-amino-3,5-dibromo-phenyl)methylamino]cyclohexan-1-ol;1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid with trans-4-[[(2-Amino-3,5-dibromophenyl)methyl]amino]cyclohexanol;Acebrophylline

  • Categories:

    Organic Chemistry  >  Amides

2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid Basic Attributes

616.3

238.07000

0HM1E174TN

Characteristics

154

-1.48170

468.6ºC at 760 mmHg

237.2ºC

1.38E-09mmHg at 25°C

Safety Information

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P337+P313, P363, P501

H302

Drug Information

acebrophylline

Computed Properties

Molecular Weight:616.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:616.04674
Monoisotopic Mass:614.04879
Topological Polar Surface Area:154
Heavy Atom Count:35
Complexity:645
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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