CAS No.84478-72-8,5-amino-2-chloro-4-fluoro-phenol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	84478-72-8
Name:	5-amino-2-chloro-4-fluoro-phenol
Article Data:	5

Formula:	C₆H₅ClFNO
Molecular Weight:	161.563
Synonyms:	2-Chloro-4-fluoro-5-aminophenol;2-Fluoro-4-chloro-5-hydroxyaniline;4-Chloro-2-fluoro-5-hydroxyaniline;5-Amino-2-chloro-4-fluorophenol;
Density:	1.519 g/cm³
Melting Point:	157-160 °C
Boiling Point:	271.9 °C at 760 mmHg
Flash Point:	118.2 °C
PSA:	46.25000
LogP:	2.34810

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Specification

The 5-Amino-2-chloro-4-fluorophenol, with the CAS registry number 84478-72-8, is also known as 2-Chloro-4-fluoro-5-amino phenol. It belongs to the product category of API Intermediates. This chemical's molecular formula is C₆H₅ClFNO and molecular weight is 161.5614. What's more, both its IUPAC name and systematic name are the same which is called 5-Amino-2-chloro-4-fluorophenol.

Physical properties about 5-Amino-2-chloro-4-fluorophenol are: (1) ACD/LogP: 1.25; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 1.25; (4) ACD/LogD (pH 7.4): 1.22; (5) ACD/BCF (pH 5.5): 5.26; (6) ACD/BCF (pH 7.4): 4.88; (7) ACD/KOC (pH 5.5): 114.18; (8) ACD/KOC (pH 7.4): 105.8; (9) #H bond acceptors: 2; (10) #H bond donors: 3; (11) #Freely Rotating Bonds: 2; (12) Polar Surface Area: 12.47 Å²; (13) Index of Refraction: 1.618; (14) Molar Refractivity: 37.25 cm³; (15) Molar Volume: 106.3 cm³; (16) Surface Tension: 56.2 dyne/cm; (17) Density: 1.519 g/cm³; (18) Flash Point: 118.2 °C; (19) Enthalpy of Vaporization: 53.07 kJ/mol; (20) Boiling Point: 271.9 °C at 760 mmHg; (21) Vapour Pressure: 0.00377 mmHg at 25 °C; (22) Melting Point: 157-160 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1cc(F)c(N)cc1O
(2) InChI: InChI=1/C6H5ClFNO/c7-3-1-4(8)5(9)2-6(3)10/h1-2,10H,9H2
(3) InChIKey: AFZLCOLNTRPSIF-UHFFFAOYAM