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2,3,4,5,6-Pentafluoroaniline

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

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

Precursor & DownStream

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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