Basic information
- Name:
2-Propanal, 1-(1H-indol-4-yloxy)-3-((1-methylethyl)amino)-, (S)-
- CAS No.:
26328-11-0
- Molecular Structure:
- Formula:
- C14H20N2O2
- Molecular Weight:
- 248.32
- Density:
- 1.152 g/cm3
- Boiling Point:
- 457.1 °C at 760 mmHg
- Flash Point:
- 230.3 °C
- Solubility:
- 0.1 M NaOH: 0.2 mg/mL
- Appearance:
- solid
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Specification
This chemical is called 2-Propanal, 1-(1H-indol-4-yloxy)-3-((1-methylethyl)amino)-, (S)-, and its systematic name is .(2S)-1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-ol. With CAS registry number of 26328-11-0, its product categories are Adrenergics; Antagonists; Neurotransmitters. Additionally, it should be sealed in the cool and dry plcace, away from oxides.
Other characteristics of the 2-Propanal, 1-(1H-indol-4-yloxy)-3-((1-methylethyl)amino)-, (S)- can be summarised as followings: (1)ACD/LogP: 1.97; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 26.63 Å2; (7)Index of Refraction: 1.596; (8)Molar Refractivity: 73.41 cm3; (9)Molar Volume: 215.4 cm3; (10)Polarizability: 29.1×10-24cm3; (11)Surface Tension: 47.5 dyne/cm; (12)Density: 1.152 g/cm3; (13)Flash Point: 230.3 °C; (14)Enthalpy of Vaporization: 75.57 kJ/mol; (15)Boiling Point: 457.1 °C at 760 mmHg; (16)Vapour Pressure: 3.77E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O[C@@H](CNC(C)C)COc1cccc2c1ccn2
2.InChI: InChI=1/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3/t11-/m0/s1
3.InChIKey: JZQKKSLKJUAGIC-NSHDSACABH
