S-tert-butyl 2-(1,2,4-triazol-1-yl)ethanethioate

Modify Date: 2025-09-28 08:30:13

S-tert-butyl 2-(1,2,4-triazol-1-yl)ethanethioate Structure
S-tert-butyl 2-(1,2,4-triazol-1-yl)ethanethioate structure
Common Name S-tert-butyl 2-(1,2,4-triazol-1-yl)ethanethioate
CAS Number 91040-88-9 Molecular Weight 199.27300
Density N/A Boiling Point N/A
Molecular Formula C8H13N3OS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name S-tert-butyl 2-(1,2,4-triazol-1-yl)ethanethioate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C8H13N3OS
Molecular Weight 199.27300
Exact Mass 199.07800
PSA 73.08000
LogP 1.33640
InChIKey FZABFLROUFMQRG-UHFFFAOYSA-N
SMILES CC(C)(C)SC(=O)Cn1cncn1

 Synonyms

1H-1,2,4-Triazole-1-ethanethioic acid,S-(1,1-dimethylethyl) ester
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