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CS-W001157 4
Total: USD 88.00

N-Cyano-N′-[2-[[(4-methyl-1H-imidazol-5-yl)methyl]thio]ethyl]-,Carbamimidothioic acid methyl ester Cimetidine Impurity

  • CAS No. 52378-40-2

  • Cat. No. CS-0533353
  • Molecule weight269.39
  • Purity≥98%
  • MDL No.None

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

N-Cyano-N′-[2-[[(4-methyl-1H-imidazol-5-yl)methyl]thio]ethyl]-,Carbamimidothioic acid methyl ester Cimetidine Impurity|CS-0533353

Structure of 52378-40-2

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General Information

  • CAS No. 52378-40-2
  • Cat. No. CS-0533353
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₅N₅S₂
  • Molecular Weight 269.39
  • Synonym(s) N-Cyano-N-[2-(5-methylimidazole-4-methylthio)ethyl]-S-methyl isothiourea
  • SMILES N#CN/C(SC)=N/CCSCC1=C(C)N=CN1

Description

4-hydroxybenzaldehyde occurs naturally in vanilla beans and is one of the keys contributors to the vanilla flavor.

Safety Information

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GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H312-H317-H332-H334
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P501

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Computational Chemistry Data

  • TPSA   76.86
  • LogP   1.741
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   5

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