1H-Indole,4-fluoro-2-methyl-5-(phenylmethoxy)- supplier

Name
4-Fluoro-2-methyl-5-(phenylmethoxy)-1H-indole
EINECS
CAS No. 649736-47-0
Density 1.233 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₄FNO
Boiling Point 429.349 °C at 760 mmHg
Molecular Weight 255.292
Flash Point 213.463 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Benzyloxy-4-fluoro-2-methyl-1H-indole;
PSA 25.02000
LogP 4.19440

1H-Indole,4-fluoro-2-methyl-5-(phenylmethoxy)- Specification

The 1H-Indole,4-fluoro-2-methyl-5-(phenylmethoxy)-, with the CAS registry number 649736-47-0, is also known as 5-Benzyloxy-4-fluoro-2-methyl-1H-indole. This chemical's molecular formula is C₁₆H₁₄FNO and molecular weight is 255.29. Its systematic name is called 5-(benzyloxy)-4-fluoro-2-methyl-1H-indole.

Physical properties of 1H-Indole,4-fluoro-2-methyl-5-(phenylmethoxy)-: (1)ACD/LogP: 3.74; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 877; (5)ACD/BCF (pH 7.4): 877; (6)ACD/KOC (pH 5.5): 4448; (7)ACD/KOC (pH 7.4): 4448; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.639; (12)Molar Refractivity: 74.513 cm³; (13)Molar Volume: 207.06 cm³; (14)Surface Tension: 47.748 dyne/cm; (15)Density: 1.233 g/cm³; (16)Flash Point: 213.463 °C; (17)Enthalpy of Vaporization: 65.816 kJ/mol; (18)Boiling Point: 429.349 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(ccc2nc(C)cc12)OCc3ccccc3
(2)InChI: InChI=1/C16H14FNO/c1-11-9-13-14(18-11)7-8-15(16(13)17)19-10-12-5-3-2-4-6-12/h2-9,18H,10H2,1H3
(3)InChIKey: YKJPLFDIYRGJGR-UHFFFAOYAT

Product Name

4-Fluoro-2-methyl-5-(phenylmethoxy)-1H-indole

1H-Indole,4-fluoro-2-methyl-5-(phenylmethoxy)- Specification

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