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Substance Name: Patent alum
RN: 7784-31-8
UNII: TCS9L00G8F
InChIKey: AMVQGJHFDJVOOB-UHFFFAOYSA-H

Classification Code

  • Mutation Data

Molecular Formula

  • Al2-O12-S3.18H2-O

Molecular Weight

  • 666.4164
 
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Names and Synonyms

Results Name

  • Patent alum

Name of Substance

  • Aluminium sulfate octadecahydrate

Synonyms

  • Aluminum sulfate octadecahydrate
  • Aluminum sulphate octadecahydrate
  • Cake alum octadecahydrate
  • Dialuminum sulfate octadecahydrate
  • Patent alum
  • UNII-TCS9L00G8F

Systematic Name

  • Sulfuric acid, aluminum salt (3:2), octadecahydrate

Registry Numbers

CAS Registry Number

  • 7784-31-8

FDA UNII

  • TCS9L00G8F

System Generated Number

  • 0007784318

Molecular Formulas

Molecular Formula

  • Al2-O12-S3.18H2-O

Molecular Formula Fragments

  • Al2-O12-S3
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/2Al.3H2O4S.18H2O/c;;3*1-5(2,3)4;;;;;;;;;;;;;;;;;;/h;;3*(H2,1,2,3,4);18*1H2/q2*+3;;;;;;;;;;;;;;;;;;;;;/p-6

InChIKey

AMVQGJHFDJVOOB-UHFFFAOYSA-H

Smiles

O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Al+3].[Al+3].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 997mg/kg (997mg/kg)   Pharmacology and Toxicology Vol. 60, Pg. 280, 1987.
mouse LD50 oral > 9gm/kg (9000mg/kg)   Pharmacology and Toxicology Vol. 60, Pg. 280, 1987.
rat LD50 intraperitoneal 61mg/kg (61mg/kg)   Pharmacology and Toxicology Vol. 60, Pg. 280, 1987.
rat LD50 oral > 9gm/kg (9000mg/kg)   Pharmacology and Toxicology Vol. 60, Pg. 280, 1987.