4-(Prop-2-en-1-yl)-5-(pyrazin-2-yl)-4h-1,2,4-triazole-3-thiol

Name: 4-(Prop-2-en-1-yl)-5-(pyrazin-2-yl)-4h-1,2,4-triazole-3-thiol
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CAS No. 98010-71-0
Cat. No. CS-0222181
Molecule weight219.27
Purity≥95%
MDL No.None

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4-(Prop-2-en-1-yl)-5-(pyrazin-2-yl)-4h-1,2,4-triazole-3-thiol|CS-0222181

Structure of 98010-71-0

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General Information

CAS No. 98010-71-0
Cat. No. CS-0222181
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉N₅S
Molecular Weight 219.27
Synonym(s) 4-prop-2-enyl-3-pyrazin-2-yl-1H-1,2,4-triazole-5-thione
SMILES SC1=NN=C(C2=NC=CN=C2)N1CC=C

Synthesis

Route1
- In-stock
  
  768-05-8
- ~%
- 98010-71-0
References
- Siwek, Agata; Wujec, Monika; Plech, Tomasz; KuSmierz, Edyta; Jagielo-Wojtowicz, Ewa; Chodkowska, Anna Heteroatom Chemistry, 2010 , vol. 21, # 4 p. 256 - 264
Route2
- 137724-67-5
- ~%
- 98010-71-0
References
- Siwek, Agata; Wujec, Monika; Plech, Tomasz; KuSmierz, Edyta; Jagielo-Wojtowicz, Ewa; Chodkowska, Anna Heteroatom Chemistry, 2010 , vol. 21, # 4 p. 256 - 264

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 56.49
LogP 1.2098
H_Acceptors 6
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Olefins

Building Blocks Skeleton Aromatic heterocycle compounds Pyrazine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

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4-(Prop-2-en-1-yl)-5-(pyrazin-2-yl)-4h-1,2,4-triazole-3-thiol

CAS No. 98010-71-0

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