Product Name

  • Name

    5-methoxy-3-[2-(pyrrolidin-1-yl)ethyl]-1H-indole

  • EINECS
  • CAS No. 3949-14-2
  • Article Data4
  • CAS DataBase
  • Density 1.139g/cm3
  • Solubility
  • Melting Point
  • Formula C15H20N2O
  • Boiling Point 407.7°C at 760 mmHg
  • Molecular Weight 244.37
  • Flash Point 200.3°C
  • Transport Information
  • Appearance
  • Safety Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits toxic fumes of NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 3949-14-2 (5-methoxy-3-[2-(pyrrolidin-1-yl)ethyl]-1H-indole)
  • Hazard Symbols
  • Synonyms 3-acetyl-5-methoxybenzofuran;
  • PSA 28.26000
  • LogP 2.75270

5-Methoxy-3-(2-pyrrolidinoethyl)indole Chemical Properties

IUPAC Name: 5-Methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole 
Following is the structure of 5-Methoxy-3-(2-pyrrolidinoethyl)indole (CAS NO.3949-14-2):
               
Empirical Formula: C15H20N2O
Molecular Weight: 244.3321 g/mol
Surface Tension: 48.3 dyne/cm
Density: 1.139 g/cm3
Flash Point: 200.3 °C
Enthalpy of Vaporization: 65.96 kJ/mol
Boiling Point: 407.7 °C at 760 mmHg
Vapour Pressure: 7.42E-07 mmHg at 25 °C
Index of Refraction of 5-Methoxy-3-(2-pyrrolidinoethyl)indole (CAS NO.3949-14-2): 1.614
Canonical SMILES: COC1=CC2=C(C=C1)NC=C2CCN3CCCC3
InChI: InChI=1S/C15H20N2O/c1-18-13-4-5-15-14(10-13)12(11-16-15)6-9-17-7-2-3-8-17/h4-5,10-11,16H,2-3,6-9H2,1H3
InChIKey: KAASYKNZNPWPQG-UHFFFAOYSA-N

5-Methoxy-3-(2-pyrrolidinoethyl)indole Toxicity Data With Reference

1.    

ipr-rat LD50:4 mg/kg

     BSCFAS    Bulletin de la Societe Chimique de France. 5 (1965),1411.
2.    

ipr-mus LD50:77 mg/kg

     BSCFAS    Bulletin de la Societe Chimique de France. 5 (1965),1411.
3.    

ivn-mus LD50:32 mg/kg

     BSCFAS    Bulletin de la Societe Chimique de France. 5 (1965),1411.
4.    

ivn-rbt LD50:300 µg/kg

     BSCFAS    Bulletin de la Societe Chimique de France. 5 (1965),1411.

5-Methoxy-3-(2-pyrrolidinoethyl)indole Safety Profile

Poison by intraperitoneal and intravenous routes. When heated to decomposition, 5-Methoxy-3-(2-pyrrolidinoethyl)indole (CAS NO.3949-14-2) emits toxic fumes of NOx.

5-Methoxy-3-(2-pyrrolidinoethyl)indole Specification

 5-Methoxy-3-(2-pyrrolidinoethyl)indole , its cas register number is 3949-14-2. It also can be called Methoxy-5-pyrrolidino-2'-ethyl-3-indole ; and Indole, 5-methoxy-3-(2-(1-pyrrolidinyl)ethyl)- . Its classification code is Drug / Therapeutic Agent.

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