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| CAS No.: | 2024-70-6 |
|---|---|
| Name: | FURFURYL ETHYL SULFIDE |
| Article Data: | 1 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C7H10OS |
| Molecular Weight: | 142.222 |
| Synonyms: | Ethylfurfuryl sulfide;Furfuryl ethyl sulfide; |
| Density: | 1.049 g/cm3 |
| Boiling Point: | 186 °C at 760 mmHg |
| Flash Point: | 66.3 °C |
| PSA: | 38.44000 |
| LogP: | 2.53270 |
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Specification
The CAS register number of Furan,2-[(ethylthio)methyl]- is 2024-70-6. It also can be called as (Furfurylthio)ethane and the systematic name about this chemical is 2-[(ethylsulfanyl)methyl]furan. The molecular formula about this chemical is C7H10OS and the molecular weight is 142.22.
Physical properties about Furan,2-[(ethylthio)methyl]- are: (1)ACD/LogP: 2.25; (2)ACD/LogD (pH 5.5): 2.25; (3)ACD/LogD (pH 7.4): 2.25; (4)ACD/BCF (pH 5.5): 30.39; (5)ACD/BCF (pH 7.4): 30.39; (6)ACD/KOC (pH 5.5): 400.79; (7)ACD/KOC (pH 7.4): 400.79; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 38.44Å2; (11)Index of Refraction: 1.512; (12)Molar Refractivity: 40.73 cm3; (13)Molar Volume: 135.5 cm3; (14)Polarizability: 16.14x10-24cm3; (15)Surface Tension: 34.4 dyne/cm; (16)Flash Point: 66.3 °C; (17)Enthalpy of Vaporization: 40.49 kJ/mol; (18)Boiling Point: 186 °C at 760 mmHg; (19)Vapour Pressure: 0.93 mmHg at 25°C.
Preparation: this chemical can be prepared by dithiocarbonic acid S-ethyl ester O-furan-2-ylmethyl ester at heating. This reaction will need solvent benzene. The reaction time is 2 hour(s). The yield is about 44%.
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You can still convert the following datas into molecular structure:
(1)SMILES: S(CC)Cc1occc1
(2)InChI: InChI=1/C7H10OS/c1-2-9-6-7-4-3-5-8-7/h3-5H,2,6H2,1H3
(3)InChIKey: WGQJSONNMGREEA-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C7H10OS/c1-2-9-6-7-4-3-5-8-7/h3-5H,2,6H2,1H3
(5)Std. InChIKey: WGQJSONNMGREEA-UHFFFAOYSA-N