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CAS No.: | 197783-88-3 |
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Name: | 2-AMINO-4-FLUOROBENZYL ALCOHOL |
Article Data: | 15 |
Molecular Structure: | |
Formula: | C7H8FNO |
Molecular Weight: | 141.145 |
Synonyms: | (2-Amino-4-fluorophenyl)methanol;2-Amino-4-fluorobenzenemethanol; |
Density: | 1.286 g/cm3 |
Boiling Point: | 293.799 °C at 760 mmHg |
Flash Point: | 131.485 °C |
PSA: | 46.25000 |
LogP: | 1.48140 |
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The Benzenemethanol, 2-amino-4-fluoro-, with the CAS registry number 197783-88-3, is also known as 2-Amino-4-fluorobenzenemethanol. This chemical's molecular formula is C7H8FNO and molecular weight is 141.14. What's more, its systematic name is (2-Amino-4-fluorophenyl)methanol.
Physical properties about Benzenemethanol, 2-amino-4-fluoro- are: (1)ACD/LogP: 0.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 31 ; (8)ACD/KOC (pH 7.4): 31; (9)#H bond acceptors: 2 ; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.25 Å2; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 36.934 cm3; (15)Molar Volume: 109.74 cm3; (16)Polarizability: 14.642×10-24 cm3; (17)Surface Tension: 51.357 dyne/cm; (18)Density: 1.286 g/cm3; (19)Flash Point: 131.485 °C; (20)Enthalpy of Vaporization: 56.33 kJ/mol; (21)Boiling Point: 293.799 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: OCc1ccc(F)cc1N
(2) InChI: InChI=1/C7H8FNO/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4,9H2
(3) InChIKey: XZXFGEIRYBKMMR-UHFFFAOYAU