Ethyl 2-((5-acetamido-1H-1,2,4-triazol-3-yl)thio)acetate

Name: Ethyl 2-((5-acetamido-1H-1,2,4-triazol-3-yl)thio)acetate
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CAS No. 866010-98-2
Cat. No. CS-0547796
Molecule weight244.27
Purity≥98%
MDL No.None

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Ethyl 2-((5-acetamido-1H-1,2,4-triazol-3-yl)thio)acetate|CS-0547796

Structure of 866010-98-2

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General Information

CAS No. 866010-98-2
Cat. No. CS-0547796
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₁₂N₄O₃S
Molecular Weight 244.27
Synonym(s) ethyl 2-[(3-acetamido-1H-1,2,4-triazol-5-yl)sulfanyl]acetate
SMILES CCOC(=O)CSC1=NNC(=N1)NC(=O)C

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 96.97
LogP 0.4183
H_Acceptors 6
H_Donors 2
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Amide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Key Words

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Ethyl 2-((5-acetamido-1H-1,2,4-triazol-3-yl)thio)acetate

CAS No. 866010-98-2

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