2,3,6-Trimethylphenol


Catalog No:   FT-0687168

CAS No:   2416-94-6

  • Molecular Formula:  136.19
  • Formula Weight: C9H12O
  • Inchl Key: QQOMQLYQAXGHSU-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H12O/c1-6-4-5-7(2)9(10)8(6)3/h4-5,10H,1-3H3

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
FW: 136.191
CAS: 2416-94-6
Flash_Point: 100.0±8.4 °C
MF: C9H12O
Symbol: Danger
Bolling_Point: 223.0±9.0 °C at 760 mmHg
Melting_Point: 59-62 °C(lit.)
Product_Name: 2,3,6-Trimethylphenol
Density: 1.0±0.1 g/cm3
FW: 136.191
MF: C9H12O
Refractive_Index: 1.536
Vapor_Pressure: 0.1±0.5 mmHg at 25°C
Bolling_Point: 223.0±9.0 °C at 760 mmHg
Exact_Mass: 136.088821
PSA: 20.23000
Computational_Chemistry: ['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :9 ', '6. TPSA 202 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :111 ', '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']
Molecular_Structure: ['1 . Molar refractive index 426 ', '2 . Molar volume 1366 ', '3 . Parachor (902K)3352 ', '4 . Surface tension 361 ', '5 . Polarizability 1689']
LogP: 2.86
Melting_Point: 59-62 °C(lit.)
Flash_Point: 100.0±8.4 °C
Density: 1.0±0.1 g/cm3
More_Info: ['1 . Appearance White or 淡Yellow Solid ', '2 . Density(g/mL, ,20℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)59-62 ', '5 . Boiling point(ºC,Atmospheric pressure)215 ', '6 . Boiling point(ºC 12mmHg)Unknow ', '7 . Refractive index(nD20)Unknow ', '8 . Flash point(ºC)100 ', '9 . Specific rotation(,)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(Pa,20ºC)Unknow ', '12 . Saturated vapor pressure(kPa,20ºC)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 Unknow']
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Gloves
HS_Code: 2907199090
Symbol: Danger
Risk_Statements(EU): R36/37/38
WGK_Germany: 1
Warning_Statement: P280-P305 + P351 + P338
Packing_Group: III
Safety_Statements: H315-H317-H318
RIDADR: UN 2430 8/PG 3
Hazard_Codes: Xi:Irritant;
Hazard_Class: 8

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