Benzenamine,4-bromo-5-fluoro-2-nitro- supplier

Name
4-Bromo-5-fluoro-2-nitroaniline
EINECS
CAS No. 153505-36-3
Article Data13
CAS DataBase
Density 1.896 g/cm³
Solubility
Melting Point
Formula C₆H₄BrFN₂O₂
Boiling Point 313.9 °C at 760 mmHg
Molecular Weight 235.012
Flash Point 143.6 °C
Transport Information
Appearance
Safety
Risk Codes T:;
Molecular Structure
Hazard Symbols T
Synonyms 4-Bromo-5-fluoro-2-nitroaniline;4-Bromo-5-fluoro-2-nitrophenylamine;
PSA
LogP

Benzenamine,4-bromo-5-fluoro-2-nitro- Specification

The Benzenamine,4-bromo-5-fluoro-2-nitro-, with the CAS registry number 153505-36-3, is also known as 4-Bromo-5-fluoro-2-nitrophenylamine. This chemical's molecular formula is C₆H₄BrFN₂O₂ and molecular weight is 251.47. What's more, its systematic name is 4-bromo-5-fluoro-2-nitroaniline.

Physical properties of Benzenamine,4-bromo-5-fluoro-2-nitro- are: (1)ACD/LogP: 2.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.91; (4)ACD/LogD (pH 7.4): 2.91; (5)ACD/BCF (pH 5.5): 95.93; (6)ACD/BCF (pH 7.4): 95.93; (7)ACD/KOC (pH 5.5): 912.63; (8)ACD/KOC (pH 7.4): 912.63; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 71.84 Å²; (13)Index of Refraction: 1.641; (14)Molar Refractivity: 44.71 cm³; (15)Molar Volume: 123.9 cm³; (16)Polarizability: 17.72×10^-24cm³; (17)Surface Tension: 60.8 dyne/cm; (18)Density: 1.896 g/cm³; (19)Flash Point: 143.6 °C; (20)Enthalpy of Vaporization: 55.5 kJ/mol; (21)Boiling Point: 313.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000482 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cc(F)c(Br)cc1N(=O)=O
(2)InChI: InChI=1S/C6H4BrFN2O2/c7-3-1-6(10(11)12)5(9)2-4(3)8/h1-2H,9H2
(3)InChIKey: UBANSCIKTQSEOQ-UHFFFAOYSA-N

Product Name

4-Bromo-5-fluoro-2-nitroaniline

Benzenamine,4-bromo-5-fluoro-2-nitro- Specification

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