

4-Acetylbenzoic acid
Catalog No: FT-0600907
CAS No: 586-89-0
- Molecular Formula: 164.16
- Formula Weight: C9H8O3
- Inchl Key: QBHDSQZASIBAAI-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H8O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3,(H,11,12)
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: | 208-210 °C(lit.) |
---|---|
CAS: | 586-89-0 |
MF: | C9H8O3 |
Flash_Point: | 173.6±19.7 °C |
Product_Name: | 4-Acetylbenzoic acid |
Density: | 1.2±0.1 g/cm3 |
FW: | 164.158 |
Bolling_Point: | 339.9±25.0 °C at 760 mmHg |
Refractive_Index: | 1.561 |
---|---|
Vapor_Pressure: | 0.0±0.8 mmHg at 25°C |
Flash_Point: | 173.6±19.7 °C |
LogP: | 1.61 |
Bolling_Point: | 339.9±25.0 °C at 760 mmHg |
Water_Solubility: | soluble |
PSA: | 54.37000 |
Molecular_Structure: | ['分子性质数据 ', '1 . Molar refractive index 4321 ', '2 . Molar volume 1334 ', '3 . Parachor (902K)3545 ', '4 . Surface tension 497 ', '5 . Polarizability 1713'] |
Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :2 ', '6. TPSA 544 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :190 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
Melting_Point: | 208-210 °C(lit.) |
MF: | C9H8O3 |
Exact_Mass: | 164.047348 |
FW: | 164.158 |
Density: | 1.2±0.1 g/cm3 |
More_Info: | ['1 . Appearance 针状结晶。 ', '2 . Density(g/mL,25/4℃)1229 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)208-210 ', '5 . Boiling point(ºC,Atmospheric pressure)3399 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)1736 ', '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 Soluble in Water 。'] |
Risk_Statements(EU): | R36/37/38 |
---|---|
WGK_Germany: | 3 |
Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
RIDADR: | NONH for all modes of transport |
Hazard_Codes: | Xi:Irritant; |
HS_Code: | 29183000 |
Safety_Statements: | S37/39-S26 |
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