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Thiophene,3-(phenylthio)-

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Name

Thiophene,3-(phenylthio)-

EINECS N/A
CAS No. 16718-11-9 Density 1.24 g/cm3
PSA 53.54000 LogP 3.89930
Solubility N/A Melting Point N/A
Formula C10H8S2 Boiling Point 304.7 °C at 760 mmHg
Molecular Weight 192.306 Flash Point 138.1 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 16718-11-9 (3-(PHENYLTHIO)THIOPHENE) Hazard Symbols N/A
Synonyms

3-(Phenylthio)thiophene;3-(phenylmercapto)thiophene;Phenyl 3-thienyl sulphide;

Article Data 13

Thiophene,3-(phenylthio)- Specification

The CAS register number of Thiophene,3-(phenylthio)- is 16718-11-9. It also can be called as Phenyl 3-thienyl sulphide and the IUPAC name about this chemical is 3-phenylsulfanylthiophene. The molecular formula about this chemical is C10H8S2 and the molecular weight is 192.3. If you want to store it, you should keep the container tightly sealed in dry, cool places and avoid contact with oxide. It is stable under normal temperature and pressure.

Physical properties about Thiophene,3-(phenylthio)- are: (1)ACD/LogP: 4.13; (2)ACD/LogD (pH 5.5): 4.13; (3)ACD/LogD (pH 7.4): 4.13; (4)ACD/BCF (pH 5.5): 807.78; (5)ACD/BCF (pH 7.4): 807.78; (6)ACD/KOC (pH 5.5): 4194.11; (7)ACD/KOC (pH 7.4): 4194.11  ; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 53.54 Å2; (10)Index of Refraction: 1.667; (11)Molar Refractivity: 57.61 cm3; (12)Molar Volume: 154.6 cm3; (13)Polarizability: 22.84x10-24cm3; (14)Surface Tension: 51.7 dyne/cm; (15)Density: 1.24 g/cm3; (16)Flash Point: 138.1 °C; (17)Enthalpy of Vaporization: 52.33 kJ/mol; (18)Boiling Point: 304.7 °C at 760 mmHg; (19)Vapour Pressure: 0.00155 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: S(c1ccccc1)c2ccsc2
(2)InChI: InChI=1/C10H8S2/c1-2-4-9(5-3-1)12-10-6-7-11-8-10/h1-8H
(3)InChIKey: WQYNBKIZHCGYCV-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H8S2/c1-2-4-9(5-3-1)12-10-6-7-11-8-10/h1-8H
(5)Std. InChIKey: WQYNBKIZHCGYCV-UHFFFAOYSA-N

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