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Basic Information
CAS No.: 252340-70-8
Name: 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine
Molecular Structure:
Molecular Structure of 252340-70-8 (3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine)
Formula: C10H10FN3
Molecular Weight: 191.208
Synonyms: [3-Fluoro-4-(4-methylimidazol-1-yl)phenyl]amine;3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)aniline;3-Fluoro-4-(4-methyl-imidazol-1-yl)-phenylamine;
Density: 1.268 g/cm3
Boiling Point: 371.077 °C at 760 mmHg
Flash Point: 178.221 °C
PSA: 43.84000
LogP: 2.48320
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Specification

The Benzenamine,3-fluoro-4-(4-methyl-1H-imidazol-1-yl)-, with the CAS registry number 252340-70-8, is also known as 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzenamine. This chemical's molecular formula is C10H10FN3 and molecular weight is 191.20. What's more, its systematic name is 3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)aniline.

Physical properties of Benzenamine,3-fluoro-4-(4-methyl-1H-imidazol-1-yl)- are: (1)ACD/LogP: 1.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 18; (8)ACD/KOC (pH 7.4): 91; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 43.84 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 52.141 cm3; (15)Molar Volume: 150.843 cm3; (16)Polarizability: 20.67×10-24 cm3; (17)Surface Tension: 42.242 dyne/cm; (18)Density: 1.268 g/cm3; (19)Flash Point: 178.221 °C; (20)Enthalpy of Vaporization: 61.805 kJ/mol; (21)Boiling Point: 371.077 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CN(C=N1)C2=C(C=C(C=C2)N)F
(2)InChI: InChI=1S/C10H10FN3/c1-7-5-14(6-13-7)10-3-2-8(12)4-9(10)11/h2-6H,12H2,1H3
(3)InChIKey: XUDKNXYCYIYBIG-UHFFFAOYSA-N