1-isothiocyanato-4-[(S)-methylsulfinyl]butane

Modify Date: 2025-08-21 20:47:33

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure
1-isothiocyanato-4-[(S)-methylsulfinyl]butane structure
Common Name 1-isothiocyanato-4-[(S)-methylsulfinyl]butane
CAS Number 155320-20-0 Molecular Weight 177.28800
Density 1.177g/cm3 Boiling Point 368.164ºC at 760 mmHg
Molecular Formula C6H11NOS2 Melting Point N/A
MSDS N/A Flash Point 176.459ºC

 Names

Name 1-isothiocyanato-4-[(S)-methylsulfinyl]butane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.177g/cm3
Boiling Point 368.164ºC at 760 mmHg
Molecular Formula C6H11NOS2
Molecular Weight 177.28800
Flash Point 176.459ºC
Exact Mass 177.02800
PSA 80.73000
LogP 2.11360
Vapour Pressure 0mmHg at 25°C
Index of Refraction 1.567

 Synthetic Route

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Whitesell, James K.; Wong, Man-Shing Journal of Organic Chemistry, 1994 , vol. 59, # 3 p. 597 - 601

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Whitesell, James K.; Wong, Man-Shing Journal of Organic Chemistry, 1994 , vol. 59, # 3 p. 597 - 601

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Holland, Herbert L.; Brown, Frances M.; Larsen, Brett G. Tetrahedron: Asymmetry, 1994 , vol. 5, # 7 p. 1129 - 1130

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Holland, Herbert L.; Brown, Frances M.; Larsen, Brett G.; Zabic, Mirjana Tetrahedron: Asymmetry, 1995 , vol. 6, # 7 p. 1569 - 1574

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Whitesell, James K.; Wong, Man-Shing Journal of Organic Chemistry, 1994 , vol. 59, # 3 p. 597 - 601

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Holland, Herbert L.; Brown, Frances M.; Larsen, Brett G.; Zabic, Mirjana Tetrahedron: Asymmetry, 1995 , vol. 6, # 7 p. 1569 - 1574

~%

1-isothiocyanato-4-[(S)-methylsulfinyl]butane Structure

1-isothiocyanat...

CAS#:155320-20-0

Literature: Schenk, Wolfdieter A.; Duerr, Michael Chemistry - A European Journal, 1997 , vol. 3, # 5 p. 713 - 716

 Synonyms

(-)-Sulphoraphan
(R)-4-Methansulfinyl-butylisothiocyanat
(R)-(4-Isothiocyanato-butyl)-methyl-sulfoxid
(R)-4-methanesulfinyl-butyl isothiocyanate
Sulforaphane,(S)
UNII-7J94TPZ10L
(+)-Sulforaphane
(S)-4-Methansulfinyl-butylisothiocyanat
(S)-sulforaphane
(-)1-Isothiocyanato-4R-methylsulfinyl)butane
Butane,1-isothiocyanato-4-((S)-methylsulfinyl)
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