Basic Information | Post buying leads | Suppliers |
Name |
1,3-Dioxolane-2-acetonitrile |
EINECS | N/A |
CAS No. | 26118-19-4 | Density | 1.111 g/cm3 |
PSA | 42.25000 | LogP | 0.27298 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H7NO2 | Boiling Point | 232.5 °C at 760 mmHg |
Molecular Weight | 113.116 | Flash Point | 112.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,3-Dioxolan-2-ylacetonitrile; |
The 1,3-Dioxolane-2-acetonitrile, with the CAS registry number 26118-19-4, is also known as 1,3-Dioxolan-2-ylacetonitrile. This chemical's molecular formula is C5H7NO2 and molecular weight is 113.1146. What's more, its systematic name is 2-(1,3-Dioxolan-2-yl)acetonitrile.
Physical properties about 1,3-Dioxolane-2-acetonitrile are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 3; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 42.25 Å2; (6)Index of Refraction: 1.429; (7)Molar Refractivity: 26.28 cm3; (8)Molar Volume: 101.7 cm3; (9)Polarizability: 10.42×10-24 cm3; (10)Surface Tension: 43.7 dyne/cm; (11)Density: 1.111 g/cm3; (12)Flash Point: 112.3 °C; (13)Enthalpy of Vaporization: 46.92 kJ/mol; (14)Boiling Point: 232.5 °C at 760 mmHg; (15)Vapour Pressure: 0.0587 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: N#CCC1OCCO1
(2) InChI: InChI=1/C5H7NO2/c6-2-1-5-7-3-4-8-5/h5H,1,3-4H2
(3) InChIKey: PSGGISCDILSVMS-UHFFFAOYAX