The Hepatocyte growth factor (human) 177, with the CAS registry number 188418-04-4, is also known as 1,3-Benzenediamine, 2,4-dinitro-N3,N3-dipropyl-6-(trifluoromethyl)-. This chemical's molecular formula is C13H17F3N4O4 and molecular weight is 350.2937. Its systematic name is called 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)benzene-1,3-diamine.
Physical properties of Hepatocyte growth factor (human) 177: (1)ACD/LogP: 6.92; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.92; (4)ACD/LogD (pH 7.4): 6.92; (5)ACD/BCF (pH 5.5): 106759.64; (6)ACD/BCF (pH 7.4): 106759.64; (7)ACD/KOC (pH 5.5): 138328.78; (8)ACD/KOC (pH 7.4): 138328.78; (9)#H bond acceptors: 8; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Index of Refraction: 1.556; (13)Molar Refractivity: 81.4 cm3; (14)Molar Volume: 252.9 cm3; (15)Surface Tension: 47 dyne/cm; (16)Density: 1.384 g/cm3; (17)Flash Point: 215.7 °C; (18)Enthalpy of Vaporization: 68.89 kJ/mol; (19)Boiling Point: 433 °C at 760 mmHg; (20)Vapour Pressure: 1.06E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc(c(c([N+]([O-])=O)c1N)N(CCC)CCC)[N+]([O-])=O
(2)InChI: InChI=1/C13H17F3N4O4/c1-3-5-18(6-4-2)11-9(19(21)22)7-8(13(14,15)16)10(17)12(11)20(23)24/h7H,3-6,17H2,1-2H3
(3)InChIKey: RSVPPPHXAASNOL-UHFFFAOYAG
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