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Imino(amino)methanesulfonicacid

Imino(amino)methanesulfonicacid structure

Imino(amino)methanesulfonicacid 

structure
  • CAS No:

    1184-90-3

  • Formula:

    CH4N2O3S

  • Chemical Name:

    Imino(amino)methanesulfonicacid

  • Synonyms:

    AIMSA;Thioureatrioxide;Formamidinosulfonicacid;ForMaMidinesulfonicAcid;Imino(amino)methanesulfonicacid;Amino(imino)methanesulfonicacid;1-AMino-1-iMino-MethanesulfonicAcid;Methanesulfonicacid,1-aMino-1-iMino-

  • Categories:

    Pharmaceutical Intermediates  >  Antivirals

Imino(amino)methanesulfonicacid Basic Attributes

124.12

123.994

DTXSID60152115

Characteristics

113

-1.6

Imino(amino)methanesulfonicacid Use and Manufacturing

Aminoiminomethanesulfonic acid (3.7). The procedure developed by Mosher et al. was followed.12 To a mixture containing 0.633 g (5.85 mmol) of 3.6 in 3.0 mL of glacial acetic acid at 0° C. was slowly added 1.56 mL of 32percent peracetic acid. The reaction mixture was then stirred for 16 h at room temperature. The precipitate was filtered and washed with five 5 mL portions of absolute ethanol and dried to give 3.7 as a white crystalline solid: yield 596 mg (82percent).mp 125-126° C.

Computed Properties

Molecular Weight:124.12
XLogP3:-1.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:123.99426317
Monoisotopic Mass:123.99426317
Topological Polar Surface Area:113
Heavy Atom Count:7
Complexity:162
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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