2,3,4,5,6-Pentafluoroaniline

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Names

[ CAS No. ]:
771-60-8

[ Name ]:
2,3,4,5,6-Pentafluoroaniline

[Synonym ]:
Aniline,2,3,4,5,6-pentafluoro
2H-tetrafluoroacetanilide
EINECS 212-234-2
Pentafluorophenylamine
Pentafluoroaniline
Aminopentafluorobenzene
2,3',4,4',5-PENTACHLOROBIPHENYL ETHER
perfluoroaniline
Benzenamine,2,3,4,5,6-pentafluoro
MFCD00007643
2,3,4,5,6-pentafluorophenylamine
2,3,4,5,6-pentafluoroanilline
Benzenamine, 2,3,4,5,6-pentafluoro-
2,3,4,5,6-Pentafluorobenzenamine

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
156.4±35.0 °C at 760 mmHg

[ Melting Point ]:
33-35 °C(lit.)

[ Molecular Formula ]:
C6H2F5N

[ Molecular Weight ]:
183.079

[ Flash Point ]:
73.9±0.0 °C

[ Exact Mass ]:
183.010742

[ PSA ]:
26.02000

[ LogP ]:
2.65

[ Vapour Pressure ]:
2.9±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.453

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BY7920000
CHEMICAL NAME :
Aniline, 2,3,4,5,6-pentafluoro-
CAS REGISTRY NUMBER :
771-60-8
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C6-H2-F5-N
MOLECULAR WEIGHT :
183.09
WISWESSER LINE NOTATION :
ZR BF CF DF EF FF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
390 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Lungs, Thorax, or Respiration - respiratory depression Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
IZSBAI Izvestiya Sibirskogo Otdeleniya Akademii Nauk SSSR, Seriya Biologomeditsinskikh Nauk. (Novosibirsk, USSR) No.1-3, 1963-68. For publisher information, see ISBNBN. Volume(issue)/page/year: 3,91,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
384 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Lungs, Thorax, or Respiration - respiratory depression Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
IZSBAI Izvestiya Sibirskogo Otdeleniya Akademii Nauk SSSR, Seriya Biologomeditsinskikh Nauk. (Novosibirsk, USSR) No.1-3, 1963-68. For publisher information, see ISBNBN. Volume(issue)/page/year: 3,91,1965

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R36/37/38

[ Safety Phrases ]:
S26-S36-S36/37/39

[ RIDADR ]:
2811.0

[ WGK Germany ]:
3

[ RTECS ]:
BY7920000

[ Packaging Group ]:
I; II; III

[ Hazard Class ]:
6.1

[ HS Code ]:
29214210

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • IODOPENTAFLUOROBENZENE
  • (Pentafluorophenyl)hydrazine
  • perfluoronitrobenzene
  • 1-azido-2,3,4,5,6-pentafluorobenzene
  • Perfluorobenzene
  • Pentafluorobenzoyl chloride
  • N-benzyloxy-F-benzamide
  • Pentafluoroanilinobordibromid

DownStream

  • Pentafluorophenyl Isothiocyanate
  • 2,3,4,5-Tetrafluoroaniline
  • pentafluoronitrosobenzene
  • oxido-(2,3,4,5,6-pentafluorophenyl)-(2,3,4,5,6-pentafluorophenyl)iminoazanium
  • 1-azido-2,3,4,5,6-pentafluorobenzene
  • Benzenamine,2,3,4,6-tetrafluoro-5-hydrazinyl-
  • 2-(2,3,4,5,6-PENTAFLUOROANILINO)-1-ETHANOL
  • N-(2,3,4,5,6-pentafluorophenyl)pyridin-2-amine
  • Decafluorobiphenyl
  • IODOPENTAFLUOROBENZENE

Customs

[ HS Code ]: 2921420090

[ Summary ]:
HS:2921420090 aniline derivatives and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles

The pH-dependence of organofluorine binding domain preference in dissolved humic acid.

Chemosphere 90(2) , 270-5, (2013)

In this study we explore the relationship between solution pH and the distribution of the binding interactions at different domains of a dissolved humic acid (HA) for three xenobiotics: pentafluoroani...

Molecular rearrangement reactions in the gas phase triggered by electron attachment.

Phys. Chem. Chem. Phys. 15(13) , 4754-66, (2013)

Bond formation and rearrangement reactions in gas phase electron attachment were studied through dissociative electron attachment (DEA) to pentafluorotoluene (PFT), pentafluoroaniline (PFA) and pentaf...

Bioactivation of 4-fluorinated anilines to benzoquinoneimines as primary reaction products.

Chem. Biol. Interact. 77(3) , 263-81, (1991)

Metabolism and bioactivation of fluoroanilines was studied both in vitro in microsomal systems and in vivo. 4-Fluoroaniline and pentafluoroaniline and their non-para fluorinated analogues were used as...


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Related Compounds

  • N-benzyl-2,3,4,5,6-pentafluoroaniline
  • N,N-dichloro-2,3,4,5,6-pentafluoroaniline
  • N,N-Dimethyl-2,3,4,5,6-pentafluoroaniline
  • N-(4-chlorophenyl)-2,3,4,5,6-pentafluoroaniline
  • N-(3,5-difluorophenyl)-2,3,4,5,6-pentafluoroaniline
  • 2,3,4,5,6-pentafluoroaniline,2,3,4,5,6-pentafluorophenol
  • 8-Methyl-4-(2,5-dimethyl-1h-indol-3-yl)quinoline
  • rac Desisopropyl Tolterodine Methyl Ether
  • 3-Bromo-8-morpholinopyrido[2,3-d]pyridazine
  • N-cyclopropyl-4-methyl-3-(1-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4, 3-a]pyrazin-7(8H)-yl)phthalazin-6-yl)benzamide
  • Ethyl 4-(2-chloroethyl)piperidine-4-carboxylate
  • 3-[(1-Benzothiophen-3-yl)methyl]pyrrolidin-3-ol
  • 3-[(4-Tert-butylphenyl)methyl]pyrrolidin-3-ol
  • 3-Methoxy-4-(4-methoxypyrimidin-5-yl)aniline
  • (R)-2-Amino-2-(6-methylpyridin-3-yl)ethanol
  • 2-[(3-Amino-4-methylpyridin-2-yl)oxy]ethan-1-ol
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