4-(Benzo[d][1,3]dioxol-5-yl)-5-methyl-4H-1,2,4-triazole-3-thiol

Name: 4-(Benzo[d][1,3]dioxol-5-yl)-5-methyl-4H-1,2,4-triazole-3-thiol
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CAS No. 669755-93-5
Cat. No. CS-0322676
Purity≥97%
MDL No.None

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4-(Benzo[d][1,3]dioxol-5-yl)-5-methyl-4H-1,2,4-triazole-3-thiol|CS-0322676

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General Information

CAS No. 669755-93-5
Cat. No. CS-0322676
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₉N₃O₂S
Molecular Weight 235.26
Synonym(s) 4-(1,3-Benzodioxol-5-yl)-5-methyl-4H-1,2,4-triazole-3-thiol
SMILES CC1=NN=C(N1C2=CC3=C(C=C2)OCO3)S

Safety Information

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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 49.17
LogP 1.59312
H_Acceptors 6
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Building Blocks Skeleton Aromatic heterocycle compounds Benzodioxolane compounds

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4-(Benzo[d][1,3]dioxol-5-yl)-5-methyl-4H-1,2,4-triazole-3-thiol

CAS No. 669755-93-5

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