Product Name

  • Name

    THEOPHYLLOL

  • EINECS
  • CAS No. 8002-89-9
  • Density
  • Solubility
  • Melting Point
  • Formula C7H8N4O2•C2H4O2•Na
  • Boiling Point
  • Molecular Weight 263.24
  • Flash Point
  • Transport Information
  • Appearance
  • Safety Poison by ingestion, intraperitoneal, intravenous, and subcutaneous routes. When heated to decomposition it emits toxic fumes of NOx and Na2O. See also THEOPHYLLINE.
  • Risk Codes
  • Molecular Structure Molecular Structure of 8002-89-9 (THEOPHYLLOL)
  • Hazard Symbols
  • Synonyms THEOPHYLLINE SODIUM ACETATE;THEOPHYLLOL;aceticacid,sodiumsalt,compd.withtheophylline(1:1);aceticacid,sodiumsalt,mixt.with3,7-dihydro-1,3-dimethyl-1h-purine-2,6-d;acet-theocinsodium;ionesodiumsalt;theocinsoluble;theophylline,compd.withsodiumacetate(1:1)
  • PSA 101.95000
  • LogP -2.49770

THEOPHYLLINE SODIUM ACETATE Chemical Properties

Product Name: Theophylline sodium acetate (CAS NO.8002-89-9)


Molecular Formula: C7H8N4O2•C2H4O2•Na
Molecular Weight: 263.24g/mol
Mol File: 8002-89-9.mol
Appearance: White, odorless, crystalline powder; bitter taste
H-Bond Donor: 1
H-Bond Acceptor: 5
Tautomer Count: 3
Topological Polar Surface Area: 109
Heavy Atom Count: 18
Complexity: 302
Covalently-Bonded Unit Count: 3

THEOPHYLLINE SODIUM ACETATE Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 205mg/kg (205mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 194, 1957.
guinea pig LD50 subcutaneous 180mg/kg (180mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 194, 1957.
mouse LD50 intraperitoneal 184mg/kg (184mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION		 Acta Pharmaceutica Jugoslavica. Vol. 24, Pg. 89, 1974.
mouse LD50 intravenous 257mg/kg (257mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 194, 1957.
mouse LD50 subcutaneous 286mg/kg (286mg/kg) PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE

BEHAVIORAL: TETANY

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 197, Pg. 193, 1941.
rat LD50 intravenous 311mg/kg (311mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 194, 1957.
rat LD50 oral 583mg/kg (583mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 194, 1957.
rat LD50 subcutaneous 188mg/kg (188mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 230, Pg. 194, 1957.

THEOPHYLLINE SODIUM ACETATE Safety Profile

Poison by ingestion, intraperitoneal, intravenous, and subcutaneous routes. When heated to decomposition it emits toxic fumes of NOx and Na2O. See also THEOPHYLLINE.

THEOPHYLLINE SODIUM ACETATE Specification

 Theophylline sodium acetate ,its CAS NO. is 8002-89-9,the synonyms is Acet-theocin sodium ; Theacitin ; Theocin soluble ; 
 Acetic acid, sodium salt, mixt. with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione sodium salt ; Theophylline, compd. with sodium acetate (1:1) ; Theophylline, sodium acetate ; Theophyllinum natrium aceticum ; UNII-88AO1K4HJ3 .

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