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CAS No.: | 39232-85-4 |
---|---|
Name: | 5-Bromo-2-chloropyridine |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C11H13NO |
Molecular Weight: | 175.23 |
Synonyms: | 2-(7-Methyl-1H-indol-3-yl)ethanol;7-Methyltryptophol; |
EINECS: | -0 |
Density: | 1.18 g/cm3 |
Melting Point: | 85-86 °C |
Boiling Point: | 362.2 °C at 760 mmHg |
Flash Point: | 172.9 °C |
PSA: | 36.02000 |
LogP: | 2.01110 |
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The 1H-Indole-3-ethanol,7-methyl- is an organic compound with the formula C11H13NO. The systematic name of this chemical is 2-(7-methyl-1H-indol-3-yl)ethanol. With the CAS registry number 39232-85-4, it is also named as 5-Bromo-2-chloropyridine.
Physical properties about 1H-Indole-3-ethanol,7-methyl- are: (1)ACD/LogP: 1.74; (2)ACD/LogD (pH 5.5): 1.74; (3)ACD/LogD (pH 7.4): 1.74; (4)ACD/BCF (pH 5.5): 12.44; (5)ACD/BCF (pH 7.4): 12.44; (6)ACD/KOC (pH 5.5): 211.5; (7)ACD/KOC (pH 7.4): 211.51; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 36.02 Å2; (12)Index of Refraction: 1.654; (13)Molar Refractivity: 54.43 cm3; (14)Molar Volume: 148.4 cm3; (15)Polarizability: 21.58×10-24cm3; (16)Surface Tension: 53.5 dyne/cm; (17)Density: 1.18 g/cm3; (18)Flash Point: 172.9 °C; (19)Enthalpy of Vaporization: 64.17 kJ/mol; (20)Boiling Point: 362.2 °C at 760 mmHg; (21)Vapour Pressure: 7E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc2cccc1c2ncc1CCO
(2)InChI: InChI=1/C11H13NO/c1-8-3-2-4-10-9(5-6-13)7-12-11(8)10/h2-4,7,12-13H,5-6H2,1H3
(3)InChIKey: KGZBKPDQVCRMSP-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C11H13NO/c1-8-3-2-4-10-9(5-6-13)7-12-11(8)10/h2-4,7,12-13H,5-6H2,1H3
(5)Std. InChIKey: KGZBKPDQVCRMSP-UHFFFAOYSA-N