1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol supplier

Name
1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol
EINECS
CAS No. 436099-60-4
Density 1.16 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₂N₂O₂
Boiling Point 492.9 °C at 760 mmHg
Molecular Weight 262.35
Flash Point 251.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(2,3-Dimethyl-1H-indol-1-yl)-3-[(2-hydroxyethyl)amino]propan-2-ol;1H-Indole-1-ethanol, α-[[(2-hydroxyethyl)amino]methyl]-2,3-dimethyl-;
PSA 57.42000
LogP 1.59180

1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol Specification

The 1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol, with the CAS registry number 436099-60-4, is also known as 1H-Indole-1-ethanol, α-[[(2-hydroxyethyl)amino]methyl]-2,3-dimethyl-. This chemical's molecular formula is C₁₅H₂₂N₂O₂ and molecular weight is 262.35. What's more, its systematic name is 1-(2,3-dimethyl-1H-indol-1-yl)-3-[(2-hydroxyethyl)amino]propan-2-ol.

Physical properties of 1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol are: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.73; (4)ACD/LogD (pH 7.4): 0.77; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1.06; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 14.76; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 26.63 Å²; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 74.91 cm³; (15)Molar Volume: 225.4 cm³; (16)Polarizability: 29.7×10^-24cm³; (17)Surface Tension: 42 dyne/cm; (18)Density: 1.16 g/cm³; (19)Flash Point: 251.9 °C; (20)Enthalpy of Vaporization: 80.04 kJ/mol; (21)Boiling Point: 492.9 °C at 760 mmHg; (22)Vapour Pressure: 1.56E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(N(C2=CC=CC=C12)CC(CNCCO)O)C
(2)InChI: InChI=1S/C15H22N2O2/c1-11-12(2)17(10-13(19)9-16-7-8-18)15-6-4-3-5-14(11)15/h3-6,13,16,18-19H,7-10H2,1-2H3
(3)InChIKey: LAXQLMTYVIIFCX-UHFFFAOYSA-N

Product Name

1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol

1-(2,3-Dimethyl-indol-1-yl)-3-(2-hydroxy-ethylamino)-propan-2-ol Specification

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