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Basic Information
CAS No.: 4790-04-9
Name: 5-Benzyloxy-6-methoxyindole
Molecular Structure:
Molecular Structure of 4790-04-9 (5-Benzyloxy-6-methoxyindole)
Formula: C16H15 N O2
Molecular Weight: 253.301
Synonyms: Indole,5-(benzyloxy)-6-methoxy- (7CI,8CI); 5-Benzyloxy-6-methoxy-1H-indole;5-Benzyloxy-6-methoxyindole; NSC 92529
Density: 1.202g/cm3
Melting Point: 93-94°C
Boiling Point: 430.9°Cat760mmHg
Flash Point: 155.3°C
PSA: 34.25000
LogP: 3.75550
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Chemistry

Molecular Structure of 5-Benzyloxy-6-methoxyindole (CAS No.4790-04-9):

Molecular Formula: C16H15NO
Molecular Weight: 253.2958
CAS No: 4790-04-9
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 4
Polar Surface Area: 23.39 Å2
Index of Refraction: 1.645
Molar Refractivity: 76.37 cm3
Molar Volume: 210.5 cm3
Surface Tension: 48.6 dyne/cm
Density: 1.202 g/cm3
Flash Point: 155.3 °C
Enthalpy of Vaporization: 65.99 kJ/mol
Boiling Point: 430.9 °C at 760 mmHg
Vapour Pressure: 3.16E-07 mmHg at 25°C
InChI: InChI=1/C16H15NO2/c1-18-15-10-14-13(7-8-17-14)9-16(15)19-11-12-5-3-2-4-6-12/h2-10,17H,11H2,1H3
InChIKey: XDLZHWUPJHWVFK-UHFFFAOYAZ
Std. InChI: InChI=1S/C16H15NO2/c1-18-15-10-14-13(7-8-17-14)9-16(15)19-11-12-5-3-2-4-6-12/h2-10,17H,11H2,1H3
Std. InChIKey: XDLZHWUPJHWVFK-UHFFFAOYSA-N
Product Categories: Indole Derivatives;Building Blocks;Heterocyclic Building Blocks;Indoles

Safety Profile

WGK Germany: 3

Specification

   5-Benzyloxy-6-methoxyindole (CAS No.4790-04-9), its synonyms are 1H-Indole, 6-methoxy-5- (phenylmethoxy)- ; 1H-indole, 6-methoxy-5-(phenylmethoxy)- ; 5-(Benzyloxy)-6-methoxy-1H-indole