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| CAS No.: | 31121-19-4 |
|---|---|
| Name: | 2,2'-DICHLORO DIPHENYL DISULFIDE |
| Article Data: | 48 |
| Molecular Structure: | |
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| Formula: | C12H8Cl2S2 |
| Molecular Weight: | 287.234 |
| Synonyms: | Disulfide,bis(o-chlorophenyl) (6CI,8CI);Bis(2-chlorophenyl) disulfide;Bis(o-chlorophenyl) disulfide;NSC 32024; |
| Density: | 1.43 g/cm3 |
| Boiling Point: | 352.589 °C at 760 mmHg |
| Flash Point: | 157.207 °C |
| PSA: | 50.60000 |
| LogP: | 5.79280 |
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Specification
The 2,2'-Dichlorodiphenyl disulfide, with the CAS registry number 31121-19-4, is also known as Bis(2-chlorophenyl) disulfide. This chemical's molecular formula is C12H8Cl2S2 and molecular weight is 287.23. Its IUPAC name is called 1-chloro-2-[(2-chlorophenyl)disulfanyl]benzene.
Physical properties about 2,2'-Dichlorodiphenyl disulfide are: (1)ACD/LogP: 5.93; (2)# of Rule of 5 Violations: 1; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 50.6 Å2; (5)Index of Refraction: 1.694; (6)Molar Refractivity: 77.14 cm3; (7)Molar Volume: 200.7 cm3; (8)Surface Tension: 59 dyne/cm; (9)Density: 1.43 g/cm3; (10)Flash Point: 157.2 °C; (11)Enthalpy of Vaporization: 57.38 kJ/mol; (12)Boiling Point: 352.6 °C at 760 mmHg; (13)Vapour Pressure: 7.72E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C(=C1)SSC2=CC=CC=C2Cl)Cl
(2)InChI: InChI=1S/C12H8Cl2S2/c13-9-5-1-3-7-11(9)15-16-12-8-4-2-6-10(12)14/h1-8H
(3)InChIKey: IQCDDWQDDMUOCQ-UHFFFAOYSA-N