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Cas Database |
| Name |
5-Methoxy-3-(2-pyrrolidinoethyl)indole |
EINECS | N/A |
| CAS No. | 3949-14-2 | Density | 1.139g/cm3 |
| PSA | 28.26000 | LogP | 2.75270 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C15H20N2O | Boiling Point | 407.7°C at 760 mmHg |
| Molecular Weight | 244.37 | Flash Point | 200.3°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
3-acetyl-5-methoxybenzofuran; |
Article Data | 4 |
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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