3-(4-Methoxyphenyl)propionitrile (CAS: 22442-48-4) - Chemical Structure and Molecular Formula
3-(4-Methoxyphenyl)propionitrile (CAS: 22442-48-4) - Chemical Structure Thumbnail

3-(4-Methoxyphenyl)propionitrile

Catalog No:   FT-0676390

CAS No:   22442-48-4

  • Chemical Name:  3-(4-Methoxyphenyl)propionitrile
  • Molecular Formula:  C10H11NO
  • Molecular Weight:  161.20
  • InChI Key:  ORAXBZFDDWPRRD-UHFFFAOYSA-N
  • InChI:  InChI=1S/C10H11NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3H2,1H3
Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Product_Name: 3-(4-Methoxyphenyl)propionitrile
Bolling_Point: 308.5ºC at 760mmHg
Density: 1.032g/cm3
MF: C10H11NO
CAS: 22442-48-4
Melting_Point: N/A
Flash_Point: 130.1ºC
FW: 161.20000
MF: C10H11NO
Bolling_Point: 308.5ºC at 760mmHg
Exact_Mass: 161.08400
More_Info: ['1 . Boiling point（ºC）290~300， 105ºC（133pa） ', '2 相对. Density(d204) 105 ', '3 . Refractive index(n20D)15298']
PSA: 33.02000
Flash_Point: 130.1ºC
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 33 ', '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']
Density: 1.032g/cm3
Molecular_Structure: ['1 . Molar refractive index 4702 ', '2 . Molar volume 1561 ', '3 . Parachor （902K）3886 ', '4 . Surface tension 383 ', '5 . Polarizability 1864']
Vapor_Pressure: 0.000678mmHg at 25°C
FW: 161.20000
LogP: 2.15138
Refractive_Index: 1.514
Risk_Statements(EU): R20/21/22
Hazard_Codes: Xi: Irritant;
HS_Code: 2926909090
Safety_Statements: 26-36/37/39

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