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CAS No.: | 59147-02-3 |
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Name: | 4-(2-FURYL)ANILINE |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C10H9NO |
Molecular Weight: | 159.188 |
Synonyms: | p-2-Furylaniline;[4-(Furan-2-yl)phenyl]amine;4-(2-Furyl)aniline;2-(p-Aminophenyl)furan;Aniline,p-2-furyl- (7CI); |
Density: | 1.138 g/cm3 |
Melting Point: | 55.5-57 °C |
Boiling Point: | 276.8 °C at 760 mmHg |
Flash Point: | 121.2 °C |
Hazard Symbols: | Xi |
Risk Codes: | 25 |
Safety: | 45 |
PSA: | 39.16000 |
LogP: | 3.11000 |
The Benzenamine, 4-(2-furanyl)-, with the CAS registry number of 59147-02-3, is also known as 2-(p-Aminophenyl)furan. This chemical's molecular formula is C10H9NO and molecular weight is 159.18. What's more, its systematic name is called 4-Furan-2-ylaniline.
Physical properties about Benzenamine, 4-(2-furanyl)- are: (1)ACD/LogP: 1.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.95; (4)ACD/LogD (pH 7.4): 1.96; (5)ACD/BCF (pH 5.5): 17.69; (6)ACD/BCF (pH 7.4): 18.23; (7)ACD/KOC (pH 5.5): 269.76; (8)ACD/KOC (pH 7.4): 277.95; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 16.38 Å2; (13)Index of Refraction: 1.593; (14)Molar Refractivity: 47.38 cm3; (15)Molar Volume: 139.7 cm3; (16)Surface Tension: 44.1 dyne/cm; (17)Density: 1.138 g/cm3; (18)Flash Point: 121.2 °C; (19)Enthalpy of Vaporization: 51.54 kJ/mol; (20)Boiling Point: 276.8 °C at 760 mmHg; (21)Vapour Pressure: 0.00469 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: o2c(c1ccc(N)cc1)ccc2
(2) InChI: InChI=1/C10H9NO/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H,11H2
(3) InChIKey: QSKZDXHSTLCYPB-UHFFFAOYAV