Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
1-(5-Phenylthien-2-yl)ethanone |
EINECS | N/A |
CAS No. | 1665-41-4 | Density | 1.151 g/cm3 |
PSA | 45.31000 | LogP | 3.61770 |
Solubility | N/A | Melting Point |
N/A |
Formula | C12H10OS | Boiling Point | 363.8 °C at 760 mmHg |
Molecular Weight | 202.277 | Flash Point | 173.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-(5-phenylthiophen-2-yl)ethanone;Ethanone, 1-(5-phenyl-2-thienyl)-;1-(5-Phenylthiophen-2-yl)ethan-1-one |
Article Data | 40 |
This chemical is called 1-(5-Phenylthiophen-2-yl)ethanone, and its CAS registry number is 1665-41-4. With the molecular formula of C12H10OS, its molecular weight is 202.27.
Other characteristics of the 1-(5-Phenylthiophen-2-yl)ethanone can be summarised as followings: (1)ACD/LogP: 3.41; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 45.31 Å2; (7)Index of Refraction: 1.589; (8)Molar Refractivity: 59.25 cm3; (9)Molar Volume: 175.7 cm3; (10)Polarizability: 23.49×10-24cm3; (11)Surface Tension: 42.6 dyne/cm; (12)Density: 1.151 g/cm3; (13)Flash Point: 173.8 °C; (14)Enthalpy of Vaporization: 60.99 kJ/mol; (15)Boiling Point: 363.8 °C at 760 mmHg; (16)Vapour Pressure: 1.76E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(c2sc(c1ccccc1)cc2)C
2.InChI: InChI=1/C12H10OS/c1-9(13)11-7-8-12(14-11)10-5-3-2-4-6-10/h2-8H,1H3
3.InChIKey: SPXBZAHGTSZQLL-UHFFFAOYAY