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Substance Name: Menadione dimethylpyrimidinol bisulfite
RN: 14451-99-1
UNII: 63418XYJ66
InChIKey: NSXDYOBMGOUYQJ-UHFFFAOYSA-N

Molecular Formula

  • C11-H10-O5-S.C6-H8-N2-O

Molecular Weight

  • 378.403
 
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Names and Synonyms

Name of Substance

  • Menadione dimethylpyrimidinol bisulfite

Synonyms

  • CCRIS 7573
  • EINECS 238-435-5
  • Menadione dimethyl-pyrimidinol bisulfate
  • UNII-63418XYJ66

Systematic Names

  • 4,6-Dimethylpyrimidin-2-ol 1,2,3,4-tetrahydro-2-methyl-1,4-dioxonaphthalene-2-sulphonic acid (1:1)
  • Menadione dimethylpyrimidinol bisulfite

Registry Numbers

CAS Registry Number

  • 14451-99-1

FDA UNII

  • 63418XYJ66

System Generated Number

  • 0014451991

Molecular Formulas

Molecular Formula

  • C11-H10-O5-S.C6-H8-N2-O

Molecular Formula Fragments

  • C11-H10-O5-S
  • C6-H8-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C11H10O5S.C6H8N2O/c1-11(17(14,15)16)6-9(12)7-4-2-3-5-8(7)10(11)13;1-4-3-5(2)8-6(9)7-4/h2-5H,6H2,1H3,(H,14,15,16);3H,1-2H3,(H,7,8,9)

InChIKey

NSXDYOBMGOUYQJ-UHFFFAOYSA-N

Smiles

S(O)([C@@]1(C)C(c2ccccc2C(C1)=O)=O)(=O)=O.c1(nc(cc([nH]1)C)C)=O