BENZOIC ACID, 4-FLUORO-2-MERCAPTO-

Modify Date: 2024-01-12 09:59:23

BENZOIC ACID, 4-FLUORO-2-MERCAPTO- Structure
BENZOIC ACID, 4-FLUORO-2-MERCAPTO- structure
Common Name BENZOIC ACID, 4-FLUORO-2-MERCAPTO-
CAS Number 81223-43-0 Molecular Weight 172.17700
Density 1.45 g/cm3 Boiling Point 296.914ºC at 760 mmHg
Molecular Formula C7H5FO2S Melting Point N/A
MSDS N/A Flash Point 133.369ºC

 Names

Name 4-fluoro-2-sulfanylbenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.45 g/cm3
Boiling Point 296.914ºC at 760 mmHg
Molecular Formula C7H5FO2S
Molecular Weight 172.17700
Flash Point 133.369ºC
Exact Mass 171.99900
PSA 76.10000
LogP 1.81260

 Synthetic Route

~85%

BENZOIC ACID, 4-FLUORO-2-MERCAPTO- Structure

BENZOIC ACID, 4...

CAS#:81223-43-0

Literature: Takeda Chemical Industries, Ltd. Patent: EP1424336 A1, 2004 ; Location in patent: Page 133 ;

~%

BENZOIC ACID, 4-FLUORO-2-MERCAPTO- Structure

BENZOIC ACID, 4...

CAS#:81223-43-0

Literature: ACADIA PHARMACEUTICALS INC. Patent: WO2008/118141 A2, 2008 ; Location in patent: Page/Page column 299-300 ; WO 2008/118141 A2

~14%

BENZOIC ACID, 4-FLUORO-2-MERCAPTO- Structure

BENZOIC ACID, 4...

CAS#:81223-43-0

Literature: Polivka; Holubek; Svatek; et al. Collection of Czechoslovak Chemical Communications, 1981 , vol. 46, # 9 p. 2222 - 2233

~%

BENZOIC ACID, 4-FLUORO-2-MERCAPTO- Structure

BENZOIC ACID, 4...

CAS#:81223-43-0

Literature: Marciano, Daniele; Aharonson, Ziporet; Varsano, Tal; Haklai, Roni; Kloog, Yoel Bioorganic and Medicinal Chemistry Letters, 1997 , vol. 7, # 13 p. 1709 - 1714

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

4-Fluoro-2-Mercapto-Benzoic Acid
4-fluorothiosalicylic acid
Benzoicacid,4-fluoro-2-mercapto