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Name |
2-Tetradecyloxyaniline |
EINECS | 255-510-8 |
CAS No. | 41710-89-8 | Density | 0.924 g/cm3 |
PSA | 35.25000 | LogP | 6.92990 |
Solubility | N/A | Melting Point |
N/A |
Formula | C20H35NO | Boiling Point | 420.5 °C at 760 mmHg |
Molecular Weight | 305.504 | Flash Point | 187.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Tetradecyloxyaniline;o-Tetradecyloxyaniline; |
Article Data | 3 |
The CAS register number of 2-Tetradecyloxyaniline is 41710-89-8. It also can be called as Benzenamine,2-(tetradecyloxy)- and the IUPAC name about this chemical is 2-tetradecoxyaniline. The molecular formula about this chemical is C20H35NO.
Physical properties about 2-Tetradecyloxyaniline are: (1)ACD/LogP: 8.00; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.96; (4)ACD/LogD (pH 7.4): 8; (5)ACD/BCF (pH 5.5): 644767.94; (6)ACD/BCF (pH 7.4): 707005.75; (7)ACD/KOC (pH 5.5): 487995.19; (8)ACD/KOC (pH 7.4): 535100.13; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 12.47Å2; (13)Index of Refraction: 1.501; (14)Molar Refractivity: 97.39 cm3; (15)Molar Volume: 330.3 cm3; (16)Polarizability: 38.61x10-24cm3; (17)Surface Tension: 35.6 dyne/cm; (18)Enthalpy of Vaporization: 67.44 kJ/mol; (19)Boiling Point: 420.5 °C at 760 mmHg; (20)Vapour Pressure: 2.8E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccccc1N)CCCCCCCCCCCCCC
(2)InChI: InChI=1/C20H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-22-20-17-14-13-16-19(20)21/h13-14,16-17H,2-12,15,18,21H2,1H3
(3)InChIKey: IXZBAJOADDIGIP-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C20H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-22-20-17-14-13-16-19(20)21/h13-14,16-17H,2-12,15,18,21H2,1H3
(5)Std. InChIKey: IXZBAJOADDIGIP-UHFFFAOYSA-N