5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol

Modify Date: 2025-08-25 15:57:57

5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol Structure
5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol structure
Common Name 5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol
CAS Number 306936-90-3 Molecular Weight 234.31700
Density 1.19 g/cm3 Boiling Point 295.8ºC at 760 mmHg
Molecular Formula C12H14N2OS Melting Point 157-158℃
MSDS N/A Flash Point 132.7ºC

 Names

Name 5-(4-tert-butylphenyl)-3H-1,3,4-oxadiazole-2-thione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.19 g/cm3
Boiling Point 295.8ºC at 760 mmHg
Melting Point 157-158℃
Molecular Formula C12H14N2OS
Molecular Weight 234.31700
Flash Point 132.7ºC
Exact Mass 234.08300
PSA 77.72000
LogP 3.32280
InChIKey ATIYHEZPBLMRNI-UHFFFAOYSA-N
SMILES CC(C)(C)c1ccc(-c2n[nH]c(=S)o2)cc1

 Synthetic Route

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5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol Structure

5-[4-(tert-buty...

CAS#:306936-90-3

Literature: US2009/291967 A1, ; Page/Page column 39 ;

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5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol Structure

5-[4-(tert-buty...

CAS#:306936-90-3

Literature: Bioorganic and Medicinal Chemistry, , vol. 20, # 11 p. 3615 - 3621

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5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazole-2-thiol Structure

5-[4-(tert-buty...

CAS#:306936-90-3

Literature: Bioorganic and Medicinal Chemistry, , vol. 21, # 8 p. 2286 - 2297

 Synonyms

f2146-0017
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