3,5-Di(trifluoromethyl)aniline

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Names

[ CAS No. ]:
328-74-5

[ Name ]:
3,5-Di(trifluoromethyl)aniline

[Synonym ]:
EINECS 206-335-0
3,5-Bis(trifluoromethyl)aniline
3,5-Bis(trifluoromethyl)benzenamine
FXFFR CZ EXFFF
3,5-Di(Trifluoromethyl)Aniline
Benzenamine, 3,5-bis(trifluoromethyl)-
α,α,α,α',α',α'-Hexafluoro-3,5-xylidine
3,5-bis-trifluoromethyl-aniline
MFCD00000394
MBT-NH2

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
175.5±40.0 °C at 760 mmHg

[ Melting Point ]:
3ºC

[ Molecular Formula ]:
C8H5F6N

[ Molecular Weight ]:
229.13

[ Flash Point ]:
70.0±18.0 °C

[ Exact Mass ]:
229.032623

[ PSA ]:
26.02000

[ LogP ]:
4.12

[ Vapour Pressure ]:
1.1±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.423

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ZE9800000
CHEMICAL NAME :
3,5-Xylidine, alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-
CAS REGISTRY NUMBER :
328-74-5
BEILSTEIN REFERENCE NO. :
0654318
LAST UPDATED :
199709
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C8-H5-F6-N
MOLECULAR WEIGHT :
229.14
WISWESSER LINE NOTATION :
FXFFR CZ EXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
31300 ug/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - ataxia
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 4,323,1952
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,143,1954

Safety Information

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R20/21/22;R36/37/38

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

[ RIDADR ]:
2810

[ WGK Germany ]:
3

[ RTECS ]:
ZE9800000

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
29214910

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3,5-Bis(trifluoromethyl)bromobenzene
  • 3,5-di(trifluoromethyl)nitrobenzene
  • 1-Iodo-3,5-bis(trifluoromethyl)benzene
  • 1,3-Bis(trifluoromethyl)benzene
  • carbon monoxide
  • Cyclohexene

DownStream

  • 1-Fluoro-3,5-bis(trifluoromethyl)benzene
  • 1-Iodo-3,5-bis(trifluoromethyl)benzene
  • 3,5-Bis(trifluoromethyl)bromobenzene
  • 3,5-Bis(trifluoromethyl)phenol
  • 3,5-Bis(trifluoromethyl)-1,2-diaminobenzene
  • 3,5-Bis(trifluoromethyl)benzene-1-sulfonyl chloride
  • 4-Chloro-3,5-bis(trifluoromethyl)aniline
  • ethyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate
  • 1-[3,5-bis(trifluoromethyl)anilino]-3-methylthiourea
  • 3,5-BIS(TRIFLUOROMETHYL)PHENYLHYDRAZINE

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%

Related Compounds

  • 2-methyl-3,5-di(trifluoromethyl)aniline
  • N1-[2-(2-PIPERIDYL)ETHYL]-3,5-DI(TRIFLUOROMETHYL)ANILINE
  • n1-(1,1,1-triphenyl-lambda~5~-phosphanylidene)-3,5-di(trifluoromethyl)aniline
  • [3,5-di(trifluoromethyl)phenyl][4-(trifluoromethoxy)phenyl]methanone
  • 3,5-di(trifluoromethyl)phenyl isothiocyanate
  • 3,5-di(trifluoromethyl)nitrobenzene
  • 1-(6-chloropyridazin-3-yl)-N-(1-methyl-1H-indol-4-yl)piperidine-3-carboxamide
  • N-cyclopropyl-4,7-dimethoxy-1-methyl-1H-indole-2-carboxamide
  • 1-[4-(2-Methoxyphenyl)piperazin-1-yl]-4-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butan-1-one
  • 4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(pyridin-2-ylmethyl)amino]ethyl}piperazine-1-carboxamide
  • 2-[6-oxo-3-(2-thienyl)-1(6H)-pyridazinyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
  • 2-(Isoquinolin-4-yl)-2-methylpropanoic acid
  • N-cycloheptyl-4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
  • N-(7-methoxy-3-quinolyl)-2-(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetamide
  • N-[2-(5-methoxy-1H-indol-1-yl)ethyl]-3,5-dimethyl-4-isoxazolecarboxamide
  • 2-(2,2-dimethylchroman-6-yl)-N-(4-(pyridin-3-yl)thiazol-2-yl)acetamide
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