Basic Information | Post buying leads | Suppliers |
Name |
(o-Nitrobenzylidene)phenylacetonitrile |
EINECS | N/A |
CAS No. | 19016-67-2 | Density | 1.265 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C15H10N2O2 | Boiling Point | 413.4 °C at 760 mmHg |
Molecular Weight | 250.257 | Flash Point | 203.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(Z)-3-(2-Nitrophenyl)-2-phenyl-prop-2-enenitrile; |
The (o-Nitrobenzylidene)phenylacetonitrile has CAS registry number 19016-67-2. This chemical's molecular formula is C15H10N2O2 and molecular weight is 250.252100. What's more, its IUPAC name is (Z)-3-(2-Nitrophenyl)-2-phenylprop-2-enenitrile.
Physical properties about (o-Nitrobenzylidene)phenylacetonitrile are: (1)ACD/LogP: 4.04; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 69.61 Å2; (7)Index of Refraction: 1.664; (8)Molar Refractivity: 73.38 cm3; (9)Molar Volume: 197.7 cm3; (10)Polarizability: 29.09×10-24 cm3; (11)Surface Tension: 58 dyne/cm; (12)Density: 1.265 g/cm3; (13)Flash Point: 203.8 °C; (14)Enthalpy of Vaporization: 66.62 kJ/mol; (15)Boiling Point: 413.4 °C at 760 mmHg; (16)Vapour Pressure: 4.81E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=[N+]([O-])c2ccccc2\C=C(/C#N)c1ccccc1
(2) InChI: InChI=1/C15H10N2O2/c16-11-14(12-6-2-1-3-7-12)10-13-8-4-5-9-15(13)17(18)19/h1-10H/b14-10+
(3) InChIKey: QKDHOOPDLFPJKV-GXDHUFHOBK