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| Name |
Azapetine |
EINECS | N/A |
| CAS No. | 146-36-1 | Density | 1.05g/cm3 |
| PSA | 3.24000 | LogP | 3.79310 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C17H17 N | Boiling Point | 364.5°Cat760mmHg |
| Molecular Weight | 235.329 | Flash Point | 157.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion, subcutaneous, and intramuscular routes. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
5H-Dibenz[c,e]azepine,6,7-dihydro-6-(2-propenyl)- (9CI); 5H-Dibenz[c,e]azepine, 6-allyl-6,7-dihydro-(7CI,8CI); Azapetine (6CI); Ilidar base |
Azapetine Chemical Properties
Molecular Structure of Azapetine (CAS NO. 146-36-1):
IUPAC Name: 6-Prop-2-enyl-5,7-dihydrobenzo[d][2]benzazepine
Molecular Formula: C17H17N
Molecular Weight: 235.323580 g/mol
XLogP3-AA: 3.6
H-Bond Donor: 0
H-Bond Acceptor: 1
Canonical SMILES: C=CCN1CC2=CC=CC=C2C3=CC=CC=C3C1
InChI: InChI=1S/C17H17N/c1-2-11-18-12-14-7-3-5-9-16(14)17-10-6-4-8-15(17)13-18/h2-10H,1,11-13H2
InChIKey: NYGHGTMKALXFIA-UHFFFAOYSA-N
Index of Refraction: 1.59
Molar Refractivity: 75.65 cm3
Molar Volume: 224 cm3
Surface Tension: 39 dyne/cm
Density: 1.05 g/cm3
Flash Point: 157.1 °C
Enthalpy of Vaporization: 61.07 kJ/mol
Boiling Point: 364.5 °C at 760 mmHg
Vapour Pressure: 1.67E-05 mmHg at 25 °C
BRN: 0194617
EINECS of Azapetine (CAS NO. 146-36-1): 205-667-3
Azapetine Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| dog | LD50 | intravenous | 50mg/kg (50mg/kg) | Compilation of LD50 Values of New Drugs. | |
| mouse | LD50 | intramuscular | 600mg/kg (600mg/kg) | Compilation of LD50 Values of New Drugs. | |
| mouse | LD50 | intraperitoneal | 210mg/kg (210mg/kg) | Compilation of LD50 Values of New Drugs. | |
| mouse | LD50 | intravenous | 27mg/kg (27mg/kg) | Compilation of LD50 Values of New Drugs. | |
| mouse | LD50 | oral | 460mg/kg (460mg/kg) | Bollettino Chimico Farmaceutico. Vol. 98, Pg. 702, 1959. | |
| mouse | LD50 | subcutaneous | 725mg/kg (725mg/kg) | Compilation of LD50 Values of New Drugs. | |
| rabbit | LD50 | intravenous | 26mg/kg (26mg/kg) | Compilation of LD50 Values of New Drugs |
Azapetine Safety Profile
Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion, subcutaneous, and intramuscular routes. When heated to decomposition it emits toxic fumes of NOx.
Azapetine Specification
Azapetine with cas registry number of 146-36-1 is also known as 5-20-08-00106 (Beilstein Handbook Reference) ; 5H-Dibenz(c,e)azepine, 6,7-dihydro-6-allyl- ; 6-Allil-6,7-diidro-5H-dibenzo(c,l)azepina ; 6-Allil-6,7-diidro-5H-dibenzo(c,l)azepina [Italian] ; 6-Allyl-6,7-dihydro-5H-dibenz(c,e)azepine ; Azapetina ; Azapetina [Italian] ; Ilidar Base ; UNII-9TTR0UA2KC ; 5H-Dibenz(c,e)azepine, 6-allyl-6,7-dihydro- ; 6-Allyl-6,7-dihydro-5H-dibenz(c,e)azepine .
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