4-Fluorobenzenesulfonamide

Modify Date: 2024-01-02 19:15:52

4-Fluorobenzenesulfonamide Structure
4-Fluorobenzenesulfonamide structure
 Common Name 4-Fluorobenzenesulfonamide
CAS Number 402-46-0 Molecular Weight 175.18100
Density 1.428g/cm3 Boiling Point 307.9ºC at 760mmHg
Molecular Formula C6H6FNO2S Melting Point 124-127 °C(lit.)
MSDS Chinese USA Flash Point 140ºC
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name 4-Fluorobenzenesulfonamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.428g/cm3
Boiling Point 307.9ºC at 760mmHg
Melting Point 124-127 °C(lit.)
Molecular Formula C6H6FNO2S
Molecular Weight 175.18100
Flash Point 140ºC
Exact Mass 175.01000
PSA 68.54000
LogP 2.25420
Vapour Pressure 0.000705mmHg at 25°C
Index of Refraction 1.554

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DB2630000
CHEMICAL NAME :
Benzenesulfonamide, p-fluoro-
CAS REGISTRY NUMBER :
402-46-0
BEILSTEIN REFERENCE NO. :
2832246
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H6-F-N-O2-S
MOLECULAR WEIGHT :
175.19
WISWESSER LINE NOTATION :
ZSWR DF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
562 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 8,548,1965

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302-H315-H319-H335
Precautionary Statements P301 + P312 + P330-P305 + P351 + P338
Personal Protective Equipment Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard Codes T:Toxic;
Risk Phrases R23/24/25;R36/37/38
Safety Phrases S26-S36-S45
RIDADR UN 2811 6.1/PG 3
WGK Germany 3
RTECS DB2630000
HS Code 2935009090

 Synthetic Route

chloro(4-fluorophenyl)sulfone structure

chloro(4-fluoro...

CAS#:349-88-2

~88%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

Literature: Braun, Manfred; Opdenbusch, Kersten Liebigs Annales, 1997 , # 1 p. 141 - 154
N-(TERT-BUTYL)-4-FLUOROBENZENESULFONAMIDE structure

N-(TERT-BUTYL)-...

CAS#:29083-05-4

~93%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

Literature: Wan, Yiqian; Wu, Xiongyu; Kannan, Mahalingam A.; Alterman, Mathias Tetrahedron Letters, 2003 , vol. 44, # 24 p. 4523 - 4525
Fluorobenzene structure

Fluorobenzene

CAS#:462-06-6

~%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

Literature: Huntress; Carten Journal of the American Chemical Society, 1940 , vol. 62, p. 511,512
N-diazo-4-fluorobenzenesulfonamide structure

N-diazo-4-fluor...

CAS#:10493-33-1

~65%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

1-(allylsulfonyl)-4-fluorobenzene structure

1-(allylsulfony...

CAS#:104517-35-3

N-allyl-4-fluorobenzenesulfonamide structure

N-allyl-4-fluor...

CAS#:66898-23-5

Literature: Dang, Hai-Shan; Roberts, Brian P. Journal of the Chemical Society - Perkin Transactions 1, 1996 , # 13 p. 1493 - 1498
Allyltributyltin structure

Allyltributyltin

CAS#:24850-33-7

N-diazo-4-fluorobenzenesulfonamide structure

N-diazo-4-fluor...

CAS#:10493-33-1

~64%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

1-(allylsulfonyl)-4-fluorobenzene structure

1-(allylsulfony...

CAS#:104517-35-3

Detail
Literature: Dang, Hai-Shan; Roberts, Brian P. Journal of the Chemical Society - Perkin Transactions 1, 1996 , # 13 p. 1493 - 1498
Allyl(triphenyl)stannane structure

Allyl(triphenyl...

CAS#:76-63-1

N-diazo-4-fluorobenzenesulfonamide structure

N-diazo-4-fluor...

CAS#:10493-33-1

~5%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

1-(allylsulfonyl)-4-fluorobenzene structure

1-(allylsulfony...

CAS#:104517-35-3

Detail
Literature: Dang, Hai-Shan; Roberts, Brian P. Journal of the Chemical Society - Perkin Transactions 1, 1996 , # 13 p. 1493 - 1498
4-fluorobenzenesulfonyl fluoride structure

4-fluorobenzene...

CAS#:368-85-4

~%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

Literature: Yakobson,G.G. et al. J. Gen. Chem. USSR (Engl. Transl.), 1967 , vol. 37, # 1 p. 163 - 170,149 - 155
4-chlorobenzenesulfonyl fluoride structure

4-chlorobenzene...

CAS#:349-89-3

~%

4-Fluorobenzenesulfonamide Structure

4-Fluorobenzene...

CAS#:402-46-0

Literature: Yakobson,G.G. et al. J. Gen. Chem. USSR (Engl. Transl.), 1967 , vol. 37, # 1 p. 163 - 170,149 - 155

 Customs

HS Code 2935009090
Summary 2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%

 Articles4

More Articles
Superacid synthesis of halogen containing N-substituted-4-aminobenzene sulfonamides: new selective tumor-associated carbonic anhydrase inhibitors.

Bioorg. Med. Chem. 21(6) , 1555-63, (2013)

A series of new, halogen containing N-substituted 4-aminobenzenesulfonamides were synthesized by using superacid HF/SbF5 chemistry and investigated as inhibitors of several human carbonic anhydrase (h...

NMR studies of carbonic anhydrase-4-fluorobenzenesulfonamide complexes.

Biochemistry 27(12) , 4310-6, (1988)

Binding of 4-fluorobenzenesulfonamide to human carbonic anhydrases I and II has been studied by proton, fluorine, and nitrogen-15 nuclear magnetic resonance spectroscopy. All three types of experiment...

Theoretical investigation on the molecular structure, Infrared, Raman and NMR spectra of para-halogen benzenesulfonamides, 4-XC6H4SO2NH2 (X= Cl, Br or F). Karabacak M, et al.

J. Mol. Struct. 919(1) , 26-33, (2009)

 Synonyms

4-FLOUROBENZENESULFONAMIDE
4-fluorobenzesulfonamide
p-fluorophenylsulfonamide
p-fluorobenzenesulfonamide
4-fluorophenylsulfonamide
4-FLUOROBENZENESULFONAMIDE
p-Fluorobenzenesulphonamide
4-fluorobenzenesulphonamide
EINECS 206-946-2
4-(fluoro)benzenesulfonamide
MFCD00025384
4-fluorobenzensulfonamide
Benzenesulfonamide,p-fluoro
4-fluorobenzene-1-sulfonamide
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