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5-(2-Fluorophenyl)-2-thiazolamine

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Name

5-(2-Fluorophenyl)-2-thiazolamine

EINECS N/A
CAS No. 1025927-65-4 Density 1.349 g/cm3
PSA 67.88000 LogP 2.46150
Solubility N/A Melting Point N/A
Formula C9H7FN2S Boiling Point 352.692 °C at 760 mmHg
Molecular Weight 194.232 Flash Point 167.103 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1025927-65-4 (2-AMINO-5-(2-FLUOROPHENYL)-THIAZOLE) Hazard Symbols N/A
Synonyms

2-Amino-5-(2-fluorophenyl)thiazole

 

5-(2-Fluorophenyl)-2-thiazolamine Specification

The 5-(2-Fluorophenyl)-2-thiazolamine, with CAS registry number 1025927-65-4, has the systematic name of 5-(2-fluorophenyl)-1,3-thiazol-2-amine. And the chemical formula of this chemical is C9H7FN2S. And the molecular weight is 194.23.

Physical properties of 5-(2-Fluorophenyl)-2-thiazolamine: (1)ACD/LogP: 1.69; (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): 55; (6)ACD/BCF (pH 7.4): 60; (7)ACD/KOC (pH 5.5): 600; (8)ACD/KOC (pH 7.4): 652; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 67.15 Å2; (13)Index of Refraction: 1.635; (14)Molar Refractivity: 51.55 cm3; (15)Molar Volume: 143.911 cm3; (16)Polarizability: 20.436×10-24cm3; (17)Surface Tension: 54.434 dyne/cm; (18)Enthalpy of Vaporization: 59.754 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccccc1c2sc(nc2)N
(2)InChI: InChI=1/C9H7FN2S/c10-7-4-2-1-3-6(7)8-5-12-9(11)13-8/h1-5H,(H2,11,12)
(3)InChIKey: VRTBWNUGNJHAEX-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C9H7FN2S/c10-7-4-2-1-3-6(7)8-5-12-9(11)13-8/h1-5H,(H2,11,12)
(5)Std. InChIKey: VRTBWNUGNJHAEX-UHFFFAOYSA-N

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