

3-HEPTEN-2-ONE
Catalog No: FT-0615774
CAS No: 1119-44-4
- Molecular Formula: 112.17
- Formula Weight: C7H12O
- Inchl Key: JHHZQADGLDKIPM-AATRIKPKSA-N
- Inchl: InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h5-6H,3-4H2,1-2H3/b6-5+
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Melting_Point: | N/A |
---|---|
CAS: | 1119-44-4 |
MF: | C7H12O |
Flash_Point: | 49°C |
Product_Name: | 3-Hepten-2-one |
Density: | 0,86 g/cm3 |
FW: | 112.17000 |
Bolling_Point: | 63°C 13mm |
Refractive_Index: | 1.4450 |
---|---|
Vapor_Pressure: | 2.7mmHg at 25°C |
Flash_Point: | 49°C |
LogP: | 1.93170 |
Bolling_Point: | 63°C 13mm |
PSA: | 17.07000 |
Molecular_Structure: | ['1 . Molar refractive index 3456 ', '2 . Molar volume 1348 ', '3 . Parachor (902K)3029 ', '4 . Surface tension 254 ', '5 . Dielectric constant 无可用 ', '6 偶极距(10-24cm3)无可用 ', '7 . Polarizability 1370'] |
Computational_Chemistry: | ['1 . XlogP 17 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 1 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count 5 ', '6 . TPSA 171 ', '7 . Heavy Atom Count 8 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 926 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 1 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1'] |
MF: | C7H12O |
Exact_Mass: | 112.08900 |
FW: | 112.17000 |
Density: | 0,86 g/cm3 |
More_Info: | ['1 . Appearance Colourless 油状Liquid ,呈强烈尖刺青草气味。 ', '2 . Density(g/m3,25℃)086 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)162 ', '6 . Boiling point(ºC,13mm)63 ', '7 . Refractive index14450 ', '8 . Flash point(ºC)49 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(mmHg,20ºC)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 几乎Insoluble in Water ,Soluble in Ethanol and 油类。'] |
Hazard_Class: | 3 |
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Risk_Statements(EU): | R10;R36/37/38 |
RIDADR: | 1224 |
Safety_Statements: | S16 |
HS_Code: | 2914190090 |
Packing_Group: | III |
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