FT-0617486 CAS:113170-71-1 chemical structure

4-AMINO-3-BROMO-5-NITROBENZOTRIFLUORIDE

Name: 4-AMINO-3-BROMO-5-NITROBENZOTRIFLUORIDE
Rating: 4.5 (11 reviews)

Catalog No: FT-0617486

CAS No: 113170-71-1

Molecular Formula: 285.02
Formula Weight: C7H4BrF3N2O2
Inchl Key: ZUZMWPRSGJTLHW-UHFFFAOYSA-N
Inchl: InChI=1S/C7H4BrF3N2O2/c8-4-1-3(7(9,10)11)2-5(6(4)12)13(14)15/h1-2H,12H2

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Bolling_Point:	278.3±40.0 °C at 760 mmHg
CAS:	113170-71-1
MF:	C7H4BrF3N2O2
Melting_Point:	71-74 °C(lit.)
Symbol:	Warning
Density:	1.9±0.1 g/cm3
FW:	285.018
Product_Name:	2-Bromo-6-nitro-4-(trifluoromethyl)aniline
Flash_Point:	122.1±27.3 °C

Bolling_Point:	278.3±40.0 °C at 760 mmHg
LogP:	3.70
More_Info:	['1 . Appearance Yellow 晶体状粉末 ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）71-74 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC，02mmHg）Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,25ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Insoluble in Water ']
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 718 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :256 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	71-74 °C(lit.)
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Exact_Mass:	283.940826
MF:	C7H4BrF3N2O2
Density:	1.9±0.1 g/cm3
Refractive_Index:	1.562
PSA:	71.84000
Flash_Point:	122.1±27.3 °C
Molecular_Structure:	['1. Molar refractive index 497 ', '2. Molar volume 1532 ', '3. Parachor （902K）3962 ', '4. Surface tension 447 ', '5. Dielectric constant N/A ', '6. Polarizability 197 ', '7. Single isotope mass 283940817 Da ', '8. Nominal mass 284 Da ', '9. Average mass 2850181 Da']
FW:	285.018

WGK_Germany:	3
Symbol:	Warning
HS_Code:	2921420090
Safety_Statements:	S26-S36-S36/37/39
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Warning_Statement:	P261-P305 + P351 + P338
RIDADR:	NONH for all modes of transport
Risk_Statements(EU):	R36/37/38
Hazard_Codes:	Xi:Irritant;