1-tert-butylsulfanylpent-4-en-1-one

Modify Date: 2025-09-12 09:38:58

1-tert-butylsulfanylpent-4-en-1-one Structure
1-tert-butylsulfanylpent-4-en-1-one structure
 Common Name 1-tert-butylsulfanylpent-4-en-1-one
CAS Number 61540-14-5 Molecular Weight 172.28800
Density 0.939g/cm3 Boiling Point 213.5ºC at 760 mmHg
Molecular Formula C9H16OS Melting Point N/A
MSDS N/A Flash Point 72.3ºC

 Names

Name S-tert-butyl pent-4-enethioate

 Chemical & Physical Properties

Density 0.939g/cm3
Boiling Point 213.5ºC at 760 mmHg
Molecular Formula C9H16OS
Molecular Weight 172.28800
Flash Point 72.3ºC
Exact Mass 172.09200
PSA 42.37000
LogP 3.01090
Index of Refraction 1.473
InChIKey KVGJXTAZEZWBMI-UHFFFAOYSA-N
SMILES C=CCCC(=O)SC(C)(C)C

 Synthetic Route

s-tert-butyl thioacetate structure

s-tert-butyl th...

CAS#:999-90-6

allyl bromide structure

allyl bromide

CAS#:106-95-6

~%

1-tert-butylsulfanylpent-4-en-1-one Structure

1-tert-butylsul...

CAS#:61540-14-5

Literature: Gorski,R.A. et al. Tetrahedron Letters, 1976 , p. 2577 - 2580

 Precursor & DownStream

Precursor  2

DownStream  0

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