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5-(2-Acetoxyethyl)-3-((4-amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium chloride hydrochloride Thiamine Impurity

  • CAS No. 1037-29-2

  • Cat. No. CS-0532720
  • Molecule weight379.31
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

5-(2-Acetoxyethyl)-3-((4-amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium chloride hydrochloride Thiamine Impurity|CS-0532720

Structure of 1037-29-2

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General Information

  • CAS No. 1037-29-2
  • Cat. No. CS-0532720
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₀Cl₂N₄O₂S
  • Molecular Weight 379.31
  • Synonym(s) ThiaMine IMpurity H
  • SMILES O=C(C)OCCC1=C(C)[N+](CC2=CN=C(C)N=C2N)=CS1.[Cl-].Cl

Description

cis-5-Octen-1-ol has been identified as one of the volatile aroma components of apples. It may also be a potent attractant to fruit fly.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   81.98
  • LogP   -1.39566
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   5

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