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Cas Database |
| Name |
Diethyl-triazene |
EINECS | N/A |
| CAS No. | 63980-20-1 | Density | 0.92g/cm3 |
| PSA | 36.75000 | LogP | 1.37390 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C4H11 N3 | Boiling Point | 109.1°C at 760 mmHg |
| Molecular Weight | 101.151 | Flash Point | 19.8°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by subcutaneous route. Questionable carcinogen with experimental carcinogenic and tumorigenic data. An experimental teratogen. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1,3-Diethyltriazene |
Article Data | 2 |
Diethyl-triazene Chemical Properties
Molecule structure of Diethyl-triazene (CAS NO.63980-20-1):
IUPAC Name: N-Ethyldiazenylethanamine
Molecular Weight: 101.15024 g/mol
Molecular Formula: C4H11N3
Density: 0.92 g/cm3
Boiling Point: 109.1 °C at 760 mmHg
Flash Point: 19.8 °C
Index of Refraction: 1.459
Molar Refractivity: 29.76 cm3
Molar Volume: 108.8 cm3
Polarizability: 11.8×10-24 cm3
Surface Tension: 29.2 dyne/cm
Enthalpy of Vaporization: 34.78 kJ/mol
Vapour Pressure: 25.2 mmHg at 25 °C
XLogP3-AA: 1.5
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Exact Mass: 101.095297
MonoIsotopic Mass: 101.095297
Topological Polar Surface Area: 36.8
Heavy Atom Count: 7
Complexity: 50.9
Canonical SMILES: CCNN=NCC
InChI: InChI=1S/C4H11N3/c1-3-5-7-6-4-2/h3-4H2,1-2H3,(H,5,6)
InChIKey of Diethyl-triazene (CAS NO.63980-20-1): LCHNLUYWGSDIDJ-UHFFFAOYSA-N
Diethyl-triazene Toxicity Data With Reference
| 1. | mmo-esc 5 µmol/L | CRNGDP Carcinogenesis. 12 (1991),1161. | ||
| 2. | scu-rat TDLo:110 mg/kg (15D post):NEO,TER | XENOBH Xenobiotica. 3 (1973),271. | ||
| 3. | scu-rat LD50:220 mg/kg | 85JCAE Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,498. |
Diethyl-triazene Safety Profile
Poison by subcutaneous route. Questionable carcinogen with experimental carcinogenic and tumorigenic data. An experimental teratogen. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Diethyl-triazene Specification
Diethyl-triazene (CAS NO.63980-20-1) is also named as 1,3-Diethyl-1-triazene ; 1,3-Diethyltriazene ; 1,3-Diethyltriazine ; BRN 5859981 ; CCRIS 6591 ; N,N'-Diethyltriazene .
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