4-(4-Chlorophenyl)-3H-1,2,4-triazole-3,5(4H)-dione

Name: 4-(4-Chlorophenyl)-3H-1,2,4-triazole-3,5(4H)-dione
Brand: ChemScene
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CAS No. 59068-43-8
Cat. No. CS-0602957
Purity≥98%
MDL No.None

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4-(4-Chlorophenyl)-3H-1,2,4-triazole-3,5(4H)-dione|CS-0602957

Structure of 59068-43-8

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General Information

CAS No. 59068-43-8
Cat. No. CS-0602957
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₄ClN₃O₂
Molecular Weight 209.59
Synonym(s) None
SMILES C1=CC(=CC=C1N2C(=O)N=NC2=O)Cl

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 62.1
LogP 2.8522
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-(4-Chlorophenyl)-3H-1,2,4-triazole-3,5(4H)-dione

CAS No. 59068-43-8

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