3-fluorobenzoyl isothiocyanate

Modify Date: 2025-09-22 18:56:20

3-fluorobenzoyl isothiocyanate Structure
3-fluorobenzoyl isothiocyanate structure
 Common Name 3-fluorobenzoyl isothiocyanate
CAS Number 100663-24-9 Molecular Weight 181.18700
Density N/A Boiling Point N/A
Molecular Formula C8H4FNOS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-fluorobenzoyl isothiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C8H4FNOS
Molecular Weight 181.18700
Exact Mass 181.00000
PSA 61.52000
LogP 2.06870
InChIKey JUGSSMJMUUWGIN-UHFFFAOYSA-N
SMILES O=C(N=C=S)c1cccc(F)c1

 Synthetic Route

Potassium thiocyanate structure

Potassium thioc...

CAS#:333-20-0

3-Fluorobenzoyl chloride structure

3-Fluorobenzoyl...

CAS#:1711-07-5

~39%

3-fluorobenzoyl isothiocyanate Structure

3-fluorobenzoyl...

CAS#:100663-24-9

Literature: AMGEN INC.; BODE, Christiane, M.; CHENG, Alan, C.; CHOQUETTE, Deborah; LEWIS, Richard, T.; POTASHMAN, Michele, H.; ROMERO, Karina; STELLWAGEN, John, C.; WHITTINGTON, Douglas, A. Patent: WO2012/18668 A1, 2012 ; Location in patent: Page/Page column 170 ; WO 2012/018668 A1
3-Fluorobenzoic acid structure

3-Fluorobenzoic acid

CAS#:455-38-9

~%

3-fluorobenzoyl isothiocyanate Structure

3-fluorobenzoyl...

CAS#:100663-24-9

Literature: Lin, Qi; Zhang, You-Ming; Li, Man-Lin; Wei, Tai-Bao Synthetic Communications, 2012 , vol. 42, # 22 p. 3251 - 3260

 Synonyms

Benzoyl isothiocyanate,3-fluoro
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Chemsrc provides 3-fluorobenzoyl isothiocyanate(CAS#:100663-24-9) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of 3-fluorobenzoyl isothiocyanate are included as well.>> amp version: 3-fluorobenzoyl isothiocyanate

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