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Substance Name: 2-Pyrimidinethiol, 4-amino-6-hydroxy-, monohydrate
RN: 65802-56-4
InChIKey: BWYGMIYEADAIGW-UHFFFAOYSA-N

Molecular Formula

  • C4-H5-N3-O-S.H2-O

Molecular Weight

  • 161.1843
 
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Names and Synonyms

Synonym

  • 4-Amino-6-hydroxy-2-mercaptopyrimidine monohydrate

Systematic Name

  • 2-Pyrimidinethiol, 4-amino-6-hydroxy-, monohydrate

Registry Numbers

CAS Registry Number

  • 65802-56-4

System Generated Number

  • 0065802564

Molecular Formulas

Molecular Formula

  • C4-H5-N3-O-S.H2-O

Molecular Formula Fragments

  • C4-H5-N3-O-S
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C4H5N3OS.H2O/c5-2-1-3(8)7-4(9)6-2;/h1H,(H4,5,6,7,8,9);1H2

InChIKey

BWYGMIYEADAIGW-UHFFFAOYSA-N

Smiles

c1c([nH]c(=S)[nH]c1=O)N.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 178mg/kg (178mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00692,