4-BUTYLBENZONITRILE


Catalog No:   FT-0617945

CAS No:   20651-73-4

  • Molecular Formula:  159.23
  • Formula Weight: C11H13N
  • Inchl Key: KGZNJCXNPLUEQS-UHFFFAOYSA-N
  • Inchl: InChI=1S/C11H13N/c1-2-3-4-10-5-7-11(9-12)8-6-10/h5-8H,2-4H2,1H3

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: 261.7±19.0 °C at 760 mmHg
Symbol: GHS07
MF: C11H13N
Melting_Point: N/A
Flash_Point: 112.2±14.0 °C
FW: 159.228
Product_Name: 4-Butyl-Benzonitrile
CAS: 20651-73-4
Density: 1.0±0.1 g/cm3
PSA: 23.79000
Bolling_Point: 261.7±19.0 °C at 760 mmHg
Molecular_Structure: ['1 . Molar refractive index 4983 ', '2 . Molar volume (m3/mol)1656 ', '3 . Parachor (902K)4115 ', '4 表面张力(dyne/cm)380 ', '5 . Polarizability (10-24cm3)1975']
LogP: 3.71
More_Info: ['1. Appearance Unknow ', '2. Density(g/mL,25/4℃)0924 ', '3. Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4. Melting point(ºC)Unknow ', '5. Boiling point(ºC,Atmospheric pressure)132-133 ', '6. Boiling point(ºC,52kPa)Unknow ', '7. Refractive index1515 ', '8. Flash point(ºC)145 ', '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 Unknow']
MF: C11H13N
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :157 ', '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']
Refractive_Index: 1.514
Flash_Point: 112.2±14.0 °C
FW: 159.228
Exact_Mass: 159.104797
Vapor_Pressure: 0.0±0.5 mmHg at 25°C
Density: 1.0±0.1 g/cm3
Hazard_Codes: Xn,Xi
Symbol: GHS07
WGK_Germany: 3
HS_Code: 2926909090
Hazard_Class: 6.1
Safety_Statements: H302-H312-H315-H319-H332-H335
RIDADR: 3276
Warning_Statement: P261-P280-P305 + P351 + P338
Packing_Group: III
Personal_Protective_Equipment: Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Risk_Statements(EU): R20/21/22

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