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Home > Encyclopedia > 4-[[2-(Acetylamino)ethyl]dithio]-1-butanesulfinic acid sodium salt

4-[[2-(Acetylamino)ethyl]dithio]-1-butanesulfinic acid sodium salt

4-[[2-(Acetylamino)ethyl]dithio]-1-butanesulfinic acid sodium salt structure

4-[[2-(Acetylamino)ethyl]dithio]-1-butanesulfinic acid sodium salt 

structure
  • CAS No:

    19293-56-2

  • Formula:

    C8H16NNaO3S3

  • Chemical Name:

    4-[[2-(Acetylamino)ethyl]dithio]-1-butanesulfinic acid sodium salt

  • Synonyms:

    sodium 4-(2-acetamidoethyldithio)butanesulfinate;NSC342029;NSC 342029;4-(2-Acetamidoethyldithio)butanesulfinate;4-((2-Acetamidoethyl)dithio)-1-butanesulfinic acid sodium salt;1-Butanesulfinic acid, 4-((2-acetamidoethyl)dithio)-, sodium salt;4-((2-Acetamidoethyl)dithio)butanesulfinic acid, monosodium salt;1-BUTANESULFINIC ACID, 4-((2-ACETAMIDOETHYL)DITHIO)-, MONOSODIUM SALT;SCHEMBL17688675

4-[[2-(Acetylamino)ethyl]dithio]-1-butanesulfinic acid sodium salt Basic Attributes

293.4

293.019001

DTXSID10172888

Characteristics

139

Peritoneal-mouse LD50: 694mg/kg; oral-mouse LD50: 1050 mg/kg

Flammable; decomposes by heating to release fumes of nitrogen oxides, sulfur oxides and sodium oxide

Safety Information

Warehouse ventilated, low temperature and dry

Toxicity

moderately toxic

Drug Information

sodium 4-(2-acetamidoethyldithio)butanesulfinate

Computed Properties

Molecular Weight:271.4
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:271.03705692
Monoisotopic Mass:271.03705692
Topological Polar Surface Area:136
Heavy Atom Count:15
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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