Basic information
- Name:
Benzenamine,2,6-diethyl-N-(2-propoxyethyl)-
- Superlist Name:
- 2,6-Diethyl-N-(2-propoxyethyl)aniline
- CAS No.:
61874-13-3
- Molecular Structure:
- Molecular Weight:
- 235.37
- Density:
- 1.896g/cm3
- Boiling Point:
- 313.9 °C at 760 mmHg
- Flash Point:
- 143.6 °C
- Appearance:
- light yellow transparent liquid
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Specification
The Benzenamine,2,6-diethyl-N-(2-propoxyethyl)-, with CAS registry number 61874-13-3, has the systematic name of 2-bromo-4-fluoro-6-nitroaniline. Besides this, it is also called N-Propoxyethyl-2,6-Diethyl Aniline. And the chemical formula of this chemical is C15H25NO.
Physical properties of Benzenamine,2,6-diethyl-N-(2-propoxyethyl)-: (1)ACD/LogP: 3.00; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 49.06 Å2; (7)Index of Refraction: 1.641; (8)Molar Refractivity: 44.71 cm3; (9)Molar Volume: 123.9 cm3; (10)Polarizability: 17.72×10-24cm3; (11)Surface Tension: 60.8 dyne/cm; (12)Enthalpy of Vaporization: 55.5 kJ/mol; (13)Vapour Pressure: 0.000483 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(F)cc([N+]([O-])=O)c1N
(2)InChI: InChI=1/C6H4BrFN2O2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H,9H2
(3)InChIKey: HCYDUPDSEDHSQB-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H4BrFN2O2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H,9H2
(5)Std. InChIKey: HCYDUPDSEDHSQB-UHFFFAOYSA-N
