

3,5,5-Trimethylhexanoic acid
Catalog No: FT-0614415
CAS No: 3302-10-1
- Molecular Formula: 158.24
- Formula Weight: C9H18O2
- Inchl Key: OILUAKBAMVLXGF-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11)
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
CAS: | 3302-10-1 |
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FW: | 158.238 |
Flash_Point: | 109.4±9.8 °C |
Bolling_Point: | 243.3±8.0 °C at 760 mmHg |
Product_Name: | 3,5,5-Trimethylhexanoic acid |
Melting_Point: | -70°C |
MF: | C9H18O2 |
Density: | 0.9±0.1 g/cm3 |
Vapor_Pressure: | 0.0±1.0 mmHg at 25°C |
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More_Info: | ['1 . Appearance Colourless 透明Liquid ', '2 . Densityd(g/mL,25/4℃)09 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting pointmp(ºC)-70 ', '5 . Boiling point(ºC,Atmospheric pressure) 230-232 ', '6 . Boiling pointbp(ºC, 13mm )120 ', '7 . Refractive index1428-1431 ', '8 . Flash pointfp(ºC)125 ', '9 . Specific rotation(º)不确定 ', '10 . Spontaneous ignition point or ignition temperature(ºC)不确定 ', '11 . Vapor pressure(kPa,25ºC)不确定 ', '12 . Saturated vapor pressure(kPa,60ºC)不确定 ', '13 . Combustion heat(KJ/mol)不确定 ', '14 . Critical temperature(ºC)不确定 ', '15 . Critical pressure(KPa)不确定 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion(%,V/V)不确定 ', '18 . Lower limit of explosion(%,V/V)不确定 ', '19 . Solubility 微Soluble in Water '] |
Bolling_Point: | 243.3±8.0 °C at 760 mmHg |
Flash_Point: | 109.4±9.8 °C |
LogP: | 2.88 |
PSA: | 37.30000 |
FW: | 158.238 |
MF: | C9H18O2 |
Molecular_Structure: | ['1 . Molar refractive index 4523 ', '2 . Molar volume (m3/mol)1721 ', '3 . Parachor (902K)4044 ', '4 . Surface tension :304 ', '5 . Polarizability 1793'] |
Computational_Chemistry: | ['1 . XlogP 28 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 4 ', '5 . TPSA 373 ', '6 . Heavy Atom Count 11 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 133 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 1 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1'] |
Exact_Mass: | 158.130676 |
Melting_Point: | -70°C |
Refractive_Index: | 1.438 |
Density: | 0.9±0.1 g/cm3 |
Safety_Statements: | S24/25 |
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Hazard_Codes: | Xi: Irritant; |
Hazard_Class: | 8 |
RIDADR: | 3265 |
Packing_Group: | III |
Risk_Statements(EU): | R36/37/38 |
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