Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-(4-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione |
EINECS | N/A |
CAS No. | 20307-43-1 | Density | 1.365 g/cm3 |
PSA | 34.14000 | LogP | 2.43140 |
Solubility | N/A | Melting Point |
N/A |
Formula | C12H7ClO2 | Boiling Point | 360 °C at 760 mmHg |
Molecular Weight | 218.639 | Flash Point | 152.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(4-Chloro-phenyl)-[1,4]benzoquinone; 2-(4-Chlorophenyl)-1,4-benzoquinone; 2,5-Cyclohexadiene-1,4-dione, 2-(4-chlorophenyl)- |
Article Data | 2 |
This chemical is called 2-(4-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione, and it's also named as 2,5-Cyclohexadiene-1,4-dione, 2-(4-chlorophenyl)-. With the molecular formula of C12H7ClO2, its molecular weight is 218.64. The CAS registry number of this chemical is 20307-43-1.
Other characteristics of the 2-(4-Chlorophenyl)cyclohexa-2,5-diene-1,4-dione can be summarised as followings: (1)ACD/LogP: 3.18; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 34.14 Å2; (7)Index of Refraction: 1.622; (8)Molar Refractivity: 56.47 cm3; (9)Molar Volume: 160.1 cm3; (10)Polarizability: 22.38×10-24cm3; (11)Surface Tension: 53.6 dyne/cm; (12)Density: 1.365 g/cm3; (13)Flash Point: 152.1 °C; (14)Enthalpy of Vaporization: 60.57 kJ/mol; (15)Boiling Point: 360 °C at 760 mmHg; (16)Vapour Pressure: 2.28E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C2/C=C\C(=O)\C=C2\c1ccc(Cl)cc1
2.InChI: InChI=1/C12H7ClO2/c13-9-3-1-8(2-4-9)11-7-10(14)5-6-12(11)15/h1-7H
3.InChIKey: ZYZNNQZZYJAPLH-UHFFFAOYAD