2-(4-Chlorophenoxy)acetonitrile
Catalog No: FT-0618241
CAS No: 3598-13-8
- Molecular Formula: 167.59
- Formula Weight: C8H6ClNO
- Inchl Key: YUGDKEWUYZXXRU-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H6ClNO/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,6H2
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Symbol: | GHS07 |
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CAS: | 3598-13-8 |
Flash_Point: | 123.0±20.4 °C |
Product_Name: | (4-Chlorophenoxy)acetonitrile |
Bolling_Point: | 279.7±15.0 °C at 760 mmHg |
FW: | 167.592 |
Melting_Point: | 45-49 °C(lit.) |
MF: | C8H6ClNO |
Density: | 1.2±0.1 g/cm3 |
Refractive_Index: | 1.539 |
---|---|
Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
Flash_Point: | 123.0±20.4 °C |
LogP: | 2.51 |
Bolling_Point: | 279.7±15.0 °C at 760 mmHg |
PSA: | 33.02000 |
Molecular_Structure: | ['1 . Molar refractive index 4237 ', '2 . Molar volume (m3/mol)1352 ', '3 . Parachor (902K)3478 ', '4 . Surface tension 437 ', '5 . Polarizability (10 -24cm 3)1679'] |
Computational_Chemistry: | ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 33 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :155 ', '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: | 45-49 °C(lit.) |
MF: | C8H6ClNO |
Exact_Mass: | 167.013794 |
FW: | 167.592 |
Density: | 1.2±0.1 g/cm3 |
More_Info: | ['1 . Appearance 不确定 ', '2 . Densityd(g/mL,25/4℃)不确定 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting pointmp(ºC)45-49 ', '5 . Boiling point(ºC,Atmospheric pressure)不确定 ', '6 . Boiling pointbp(ºC, 15mm )149-150 ', '7 . Refractive index不确定 ', '8 . Flash pointfp(ºC)不确定 ', '9 . Specific rotation(º)不确定 ', '10 . Spontaneous ignition point or ignition temperature(ºC)不确定 ', '11 . Vapor pressure(kPa,25ºC)不确定 ', '12 . Saturated vapor pressure(kPa,60ºC)不确定 ', '13 . Combustion heat(KJ/mol)不确定 ', '14 . Critical temperature(ºC)不确定 ', '15 . Critical pressure(KPa)不确定 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion(%,V/V)不确定 ', '18 . Lower limit of explosion(%,V/V)不确定 ', '19 . Solubility 不确定'] |
Symbol: | GHS07 |
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RIDADR: | 3276 |
HS_Code: | 2926909090 |
Packing_Group: | III |
Hazard_Class: | 6.1 |
Risk_Statements(EU): | R20/21/22;R36/37/38 |
WGK_Germany: | 3 |
Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
Hazard_Codes: | Xn:Harmful; |
Warning_Statement: | P280 |
Safety_Statements: | H302-H312-H332 |