4-Allyl-5-(1-(2,4-difluorophenoxy)ethyl)-4H-1,2,4-triazole-3-thiol

Name: 4-Allyl-5-(1-(2,4-difluorophenoxy)ethyl)-4H-1,2,4-triazole-3-thiol
Brand: ChemScene
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CAS No. 861233-70-7
Cat. No. CS-0322290
Purity≥97%
MDL No.None

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4-Allyl-5-(1-(2,4-difluorophenoxy)ethyl)-4H-1,2,4-triazole-3-thiol|CS-0322290

Structure of 861233-70-7

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General Information

CAS No. 861233-70-7
Cat. No. CS-0322290
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₃F₂N₃OS
Molecular Weight 297.32
Synonym(s) 4-Allyl-5-[1-(2,4-difluorophenoxy)ethyl]-4H-1,2,4-triazole-3-thiol
SMILES C=CCN1C(=NN=C1S)C(C)OC2=C(C=C(C=C2)F)F

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 39.94
LogP 3.171
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Mercaptan

Building Blocks Functional Group Ether

Building Blocks Functional Group Olefins

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-Allyl-5-(1-(2,4-difluorophenoxy)ethyl)-4H-1,2,4-triazole-3-thiol

CAS No. 861233-70-7

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