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| Name |
4-(2,4-Dichlorophenyl)-1H-pyrrole-3-carbonitrile |
EINECS | N/A |
| CAS No. | 87388-06-5 | Density | 1.46 g/cm3 |
| PSA | 39.58000 | LogP | 3.86018 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C11H6Cl2N2 | Boiling Point | 430.6 °C at 760 mmHg |
| Molecular Weight | 237.09 | Flash Point | 214.2 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4-(2,4-dichlorophenyl)-1h-pyrrole-3-carbonitrile |
4-(2,4-Dichlorophenyl)-1H-pyrrole-3-carbonitrile Specification
The 4-(2,4-Dichlorophenyl)-1H-pyrrole-3-carbonitrile with its cas register number is 87388-06-5. The Systematic name about this chemical is 4-(2,4-dichlorophenyl)-1H-pyrrole-3-carbonitrile.
Physical properties about 4-(2,4-Dichlorophenyl)-1H-pyrrole-3-carbonitrile are: (1)ACD/LogP: 4.03; (2)ACD/LogD (pH 5.5): 4.02; (3)ACD/LogD (pH 7.4): 4.02; (4)ACD/BCF (pH 5.5): 674.37; (5)ACD/BCF (pH 7.4): 674.37; (6)ACD/KOC (pH 5.5): 3685.75; (7)ACD/KOC (pH 7.4): 3685.74; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 39.58Å2; (12)Index of Refraction: 1.656; (13)Molar Refractivity: 59.6 cm3; (14)Molar Volume: 162 cm3; (15)Polarizability: 23.62x10-24cm3; (16)Surface Tension: 65.2 dyne/cm; (17)Enthalpy of Vaporization: 68.61 kJ/mol; (18)Vapour Pressure: 1.28E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Cl)c(cc1)c2cncc2C#N
(2)InChI: InChI=1/C11H6Cl2N2/c12-8-1-2-9(11(13)3-8)10-6-15-5-7(10)4-14/h1-3,5-6,15H
(3)InChIKey: LQQWFTUQARACNM-UHFFFAOYAE
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