3-Bromo-5-fluoroaniline supplier

Name
5-AMINO-1-BROMO-3-FLUOROBENZENE
EINECS 820-947-0
CAS No. 7087-65-2
Article Data7
CAS DataBase
Density 1.695g/cm³
Solubility
Melting Point
Formula C₆H₅BrFN
Boiling Point 245.466 °C at 760 mmHg
Molecular Weight 219.998
Flash Point 102.255 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Bromo-3-fluoro-5-nitrobenzene;3-Bromo-5-fluoroaniline;
PSA 26.02000
LogP 2.75160

3-Bromo-5-fluoroaniline Specification

The 3-Bromo-5-fluoroaniline with cas registry number of 7087-65-2, whose systematic name is 3-bromo-5-fluoroaniline. And it is also named Benzenamine, 3-bromo-5-fluoro-.

Physical properties about this chemical are: (1)ACD/LogP: 2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 50; (6)ACD/BCF (pH 7.4): 50; (7)ACD/KOC (pH 5.5): 573; (8)ACD/KOC (pH 7.4): 574; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.02 Å²; (13)Index of Refraction: 1.597; (14)Molar Refractivity: 38.173 cm³; (15)Molar Volume: 112.108 cm³; (16)Polarizability: 15.133×10^-24cm³; (17)Surface Tension: 45.227 dyne/cm; (18)Enthalpy of Vaporization: 48.255 kJ/mol; (19)Vapour Pressure: 0.029 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:Fc1cc(Br)cc(N)c1;
(2)InChI:InChI=1/C6H5BrFN/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2;
(3)InChIKey:NGZAVSDIXFIWHJ-UHFFFAOYAV;
(4)Std. InChI:InChI=1S/C6H5BrFN/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2;
(5)Std. InChIKey:NGZAVSDIXFIWHJ-UHFFFAOYSA-N

Product Name

5-AMINO-1-BROMO-3-FLUOROBENZENE

3-Bromo-5-fluoroaniline Specification

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