

Dihydro-2-methyl-3(2H)-thiophenone
Catalog No: FT-0613086
CAS No: 13679-85-1
- Molecular Formula: 116.18
- Formula Weight: C5H8OS
- Inchl Key: YMZZPMVKABUEBL-UHFFFAOYSA-N
- Inchl: InChI=1S/C5H8OS/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Symbol: | GHS07 |
---|---|
CAS: | 13679-85-1 |
Flash_Point: | 71.1±0.0 °C |
Product_Name: | 2-Methylthiolan-3-one |
Bolling_Point: | 180.0±23.0 °C at 760 mmHg |
FW: | 116.181 |
Melting_Point: | N/A |
MF: | C5H8OS |
Density: | 1.1±0.1 g/cm3 |
Refractive_Index: | 1.513 |
---|---|
Vapor_Pressure: | 0.9±0.3 mmHg at 25°C |
Flash_Point: | 71.1±0.0 °C |
LogP: | 0.20 |
Bolling_Point: | 180.0±23.0 °C at 760 mmHg |
FW: | 116.181 |
PSA: | 42.37000 |
Computational_Chemistry: | ['1. XlogP :08 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :3 ', '6. TPSA 424 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :901 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
MF: | C5H8OS |
Exact_Mass: | 116.029587 |
Molecular_Structure: | ['1 . Molar refractive index 3144 ', '2 . Molar volume (m3/mol)1046 ', '3 . Parachor (902K)2561 ', '4 . Surface tension 358 ', '5 . Polarizability 1248'] |
Density: | 1.1±0.1 g/cm3 |
More_Info: | ['1 . Appearance Colourless to Yellow 芳香Liquid ', '2 . Density(g/mL,25/4℃)1116 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)83-84 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)69 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility 不能拌and 的or 难以拌and 的'] |
Symbol: | GHS07 |
---|---|
Risk_Statements(EU): | R36/37/38 |
WGK_Germany: | 3 |
Personal_Protective_Equipment: | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
HS_Code: | 2934999090 |
Hazard_Codes: | Xi:Irritant; |
Warning_Statement: | P261-P305 + P351 + P338 |
Safety_Statements: | H315-H319-H335 |
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