Methyl 4-cyanobenzoate


Catalog No:   FT-0618281

CAS No:   1129-35-7

  • Molecular Formula:  161.16
  • Formula Weight: C9H7NO2
  • Inchl Key: KKZMIDYKRKGJHG-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H7NO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,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: 274.9±0.0 °C at 760 mmHg
MF: C9H7NO2
Density: 1.2±0.1 g/cm3
FW: 161.157
Product_Name: Methyl 4-cyanobenzoate
CAS: 1129-35-7
Flash_Point: 131.2±9.4 °C
Melting_Point: 65-67 °C(lit.)
Bolling_Point: 274.9±0.0 °C at 760 mmHg
LogP: 1.85
More_Info: ['1 . Appearance 晶体状粉末 ', '2 . Density(g/cm3,25℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)65-67 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,12mmHg)142-144 ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC,12mm)142-144 ', '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 不能溶解的']
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 501 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :208 ', '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: 65-67 °C(lit.)
Vapor_Pressure: 0.0±0.5 mmHg at 25°C
Exact_Mass: 161.047684
MF: C9H7NO2
Density: 1.2±0.1 g/cm3
Refractive_Index: 1.535
PSA: 50.09000
Flash_Point: 131.2±9.4 °C
Molecular_Structure: ['1 . Molar refractive index 4243 ', '2 . Molar volume (m3/mol)1362 ', '3 . Parachor (902K)2568 ', '4 . Surface tension : 470 ', '5 . Dielectric constant 无可用 ', '6 偶极距(10 -24cm 3)无可用 ', '7 . Polarizability 1682']
FW: 161.157
HS_Code: 2926909090
RIDADR: 3439
WGK_Germany: 3
Personal_Protective_Equipment: Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard_Class: 6.1
Packing_Group: III
Safety_Statements: S22-S24/25
Risk_Statements(EU): R20/21/22

Related Products