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CAS No.: | 33898-53-2 |
---|---|
Name: | aziridine-2-carbonitrile |
Article Data: | 14 |
Molecular Structure: | |
Formula: | C3H4N2 |
Molecular Weight: | 68.0782 |
Synonyms: | 2-Cyanoaziridine;Aziridine-2-carbonitrile; |
EINECS: | 251-725-6 |
Density: | 1.11 g/cm3 |
Boiling Point: | 183.7 °C at 760 mmHg |
Flash Point: | 64.9 °C |
PSA: | 45.73000 |
LogP: | -0.18942 |
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The CAS registry number of 2-Aziridinecarbonitrile is 33898-53-2. Its EINECS registry number is 251-725-6. This chemical's molecular formula is C3H4N2 and molecular weight is 68.0773. Its systematic name is called aziridine-2-carbonitrile.
Physical properties of 2-Aziridinecarbonitrile: (1)ACD/LogP: -1.38; (2)ACD/LogD (pH 5.5): -1.39; (3)ACD/LogD (pH 7.4): -1.38; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 4.12; (7)ACD/KOC (pH 7.4): 4.22; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Index of Refraction: 1.484; (11)Molar Refractivity: 17.45 cm3; (12)Molar Volume: 60.9 cm3; (13)Surface Tension: 42.9 dyne/cm; (14)Density: 1.11 g/cm3; (15)Flash Point: 64.9 °C; (16)Enthalpy of Vaporization: 41.99 kJ/mol; (17)Boiling Point: 183.7 °C at 760 mmHg; (18)Vapour Pressure: 0.761 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N#CC1NC1
(2)InChI: InChI=1/C3H4N2/c4-1-3-2-5-3/h3,5H,2H2
(3)InChIKey: PGZUFTROELAOMP-UHFFFAOYAG