5-Bromovanillin
Catalog No: FT-0620059
CAS No: 2973-76-4
- Molecular Formula: 231.04
- Formula Weight: C8H7BrO3
- Inchl Key: KLSHZDPXXKAHIJ-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H7BrO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,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 |
Bolling_Point: | 289.5±35.0 °C at 760 mmHg |
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CAS: | 2973-76-4 |
MF: | C8H7BrO3 |
Melting_Point: | 164-166 °C(lit.) |
Symbol: | Warning |
Density: | 1.7±0.1 g/cm3 |
FW: | 231.043 |
Product_Name: | 5-Bromovanillin |
Flash_Point: | 128.9±25.9 °C |
Bolling_Point: | 289.5±35.0 °C at 760 mmHg |
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LogP: | 2.40 |
More_Info: | ['1 . Appearance 淡Yellow 结晶 ', '2 . Density(g/mL,25/4℃)无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)164-166 ', '5 . Boiling point(ºC,Atmospheric pressure)无可用 ', '6 . Boiling point(ºC,52kPa)无可用 ', '7 . Refractive index无可用 ', '8 . Flash point(ºC)无可用 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V)无可用 ', '19 . Solubility 无可用'] |
Computational_Chemistry: | ['1. XlogP :17 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :5 ', '6. TPSA 465 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :162 ', '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: | 164-166 °C(lit.) |
Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
Exact_Mass: | 229.957855 |
MF: | C8H7BrO3 |
Density: | 1.7±0.1 g/cm3 |
Refractive_Index: | 1.623 |
PSA: | 46.53000 |
Flash_Point: | 128.9±25.9 °C |
Molecular_Structure: | ['1 . Molar refractive index 4925 ', '2 . Molar volume (m3/mol)1397 ', '3 . Parachor (902K)3745 ', '4 . Surface tension 516 ', '5 . Polarizability 1952'] |
FW: | 231.043 |
WGK_Germany: | 3 |
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Symbol: | Warning |
HS_Code: | 2913000090 |
Safety_Statements: | S26-S37/39-S36/37/39-S22-S24/25-S20/21 |
Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
Warning_Statement: | P261-P305 + P351 + P338 |
RIDADR: | NONH for all modes of transport |
Risk_Statements(EU): | R36/37/38 |
Hazard_Codes: | Xi:Irritant; |